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Imazethapyr

HCID 54740
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Basic information

CAS
81335-77-5
Standard SMILES
CCc1cnc(C2=NC(C)(C(C)C)C(=O)N2)c(C(=O)O)c1
InChIKey
XVOKUMIPKHGGTN-UHFFFAOYSA-N
Molecular formula
C15H19N3O3
Average molar mass
289.33 g/mol
Monoisotopic mass
289.14264147

Overview

Imazethapyr is a member of pyridines and an aromatic carboxylic acid.

Names & identifiers

Preferred name
Imazethapyr
IUPAC
5-ethyl-2-(4-methyl-5-oxo-4-propan-2-yl-1H-imidazol-2-yl)pyridine-3-carboxylic acid
English name
Imazethapyr
Molecular formula
C15H19N3O3
Molecular weight
289.33

Names & synonyms

IMAZETHAPYR81335-77-5PursuitPivotDTXSID3024287FABIANCL 26349972T2IN94I4AC 263,499AC-263499DTXCID004287(RS)-5-Ethyl-2(4-isopropyl-4-methyl-5-oxo-2-imidazolin-2-yl)nicotinic acid
Show more names
ImazethapyOVERTOPPIVOT(R)ac263,499mazethapyrPURSUIT DGPURSUIT(R)
(+-)-2-(4,5-Dihydro-4-methyl-4(1-methylethyl)-5-oxo-1H-imidazol-2yl)-5-ethyl-3-pyridinecarboxylic acid2-(4,5-Dihydro-4-methyl-4-(1-methylethyl)-5-oxo-1H-imidazol-2-yl)-5-ethyl-3-pyridinecarboxylic acid3-Pyridinecarboxylic acid, 2-[4,5-dihydro-4-methyl-4-(1-methylethyl)-5-oxo-1H-imidazol-2-yl]-5-ethyl-CL-2634993-Pyridinecarboxylic acid, 2-(4,5-dihydro-4-methyl-4-(1-methylethyl)-5-oxo-1H-imidazol-2-yl)-5-ethyl-RefChem:147926617-222-45-ethyl-2-(4-isopropyl-4-methyl-5-oxo-4,5-dihydro-1H-imidazol-2-yl)nicotinic acid

Database identifiers

CAS
81335-77-5
PubChem CID
54740
DTXSID
DTXSID3024287
ChEMBL
CHEMBL1903400
ChEBI
CHEBI:82022
UNII
72T2IN94I4
EC Number
617-222-4
Nikkaji
J126.319F

Properties

Computed structural propertiesFilling in

XLogP
2
Topological polar surface area
91.7 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
5
Rotatable bonds
4
Heavy atoms
21
Formal charge
0
Complexity
475

Experimental & physicochemical properties

Pesticides · 6 items

Pesticide -> EPA IRIS

Herbicides, Plant Growth Regulators

Active substance -> EU Pesticides database: Not approved

Pesticides -> Herbicides, Imidazolinone

Pesticide (Imazethapyr) -> USDA PDB

Pesticide

LogP · 2 items

log Kow = 1.49 (pH 7); 1.04 (pH 5): 1.20 (pH 9), all at 25 °C

1.09

Density1.10 to 1.12 at 21 °C
Color/Form · 2 items

White to off-white crystalline solid

Off-white to tan solid

Solubility · 2 items

In acetone 48.2, methanol 105, tolulene 5, dichloromethane 185, isopropanol 17, heptane 0.9 (all in g/L, 25 °C)

In water, 1415 ppm at 25 °C

Boiling Point180 °C (decomposes)
Melting Point173 °C
Physical DescriptionWhite to off-white solid; [Merck Index] Colorless solid; [HSDB]

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

GHS classification

GHS Classification · 5 items

This chemical does not meet GHS hazard criteria for 2.2% (3 of 135) of reports.

Warning

H312 (20.7%): Harmful in contact with skin [Warning Acute toxicity, dermal]

P273, P280, P302+P352, P317, P321, P362+P364, P391, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 135 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Regulatory Information · 3 items

Imazethapyr is listed in the dataset of EPA Human Health Benchmarks for Pesticides under the Safe Drinking Water Act (40 eCFR 141)

2004/129/EC

Imazethapyr: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.

Hazards Summary · 1 item

The 5-desethyl analog of imazapyr; [ChemIDplus] In acute poisoning cases following ingestion of large amounts of an imidazolinone herbicide, patients have vomiting, hypotension, liver and kidney dysfunction, CNS impairment, and respiratory distress; May cause burns to the GI tract after ingestion; Not a skin irritant or skin sensitizer; [HSDB] May cause irritation; [MSDSonline] See Imazapyr.

FIFRA Requirements · 5 items

Tolerances are established for residues of the herbicide imazethapyr, 2-[4,5-dihydro-4-methyl-4-(1-methylethyl)-5-oxo- 1H-imidazol-2-yl]-5-ethyl-3-pyridine carboxylic acid, applied as its acid or ammonium salt, in or on the following raw agricultural commodities: [Table#6174]

Tolerances are established for the sum of the residues of the herbicide imazethapyr, 2-[4,5-dihydro-4-methyl-4-(1-methylethyl)-5-oxo- 1H-imidazol-2-yl]-5-ethyl-3-pyridine carboxylic acid; its metabolite CL 288511, 2-[4,5-dihydro-4-methyl-4-(1-methylethyl)-5-oxo-1H-imidazol-2-yl]-5-(1-hydroxyethyl)-3-pyridine carboxylic acid; and its metabolite CL 182704, 5-[1-(beta-D-glucopyranosyloxy)ethyl]-2-[4,5-dihydro-4-methyl-4-(1-methylethyl)-5-oxo-1H-imidazol-2-yl]-3-pyridinecarboxylic acid, applied as its acid or ammonium salt, in or on the following commodities: [Table#6175]

Chemistry & industry

Pharmacology

Mechanism of Action · 2 items

Absorbed by plant roots and foliage, being translocated to meristematic regions where it inhibits the biosynthesis of valine, leucine and isoleucine preventing cell division.

Imazapyr (IMZR), Imazapic (IMZC), Imazethapyr (IMZT), Imazamox (IMZX) and Imazaquin (IMZQ) ... are classified as imidazolinone (IMI) herbicides and their mode of action is to inhibit acetohydroxyacid synthase (AHAS), an enzyme involved in the biosynthesis of the amino acids leucine, isoleucine and valine. ...

Metabolism/Metabolites · 2 items

In a rat metabolism study, almost 100% of the administered radiolabeled test material /imazethapyr/ was recovered in the excreta within 96 hours (89-95% in the urine and 6-11% in the feces). Greater than 95% of the oral dose was excreted in the first 31 hours. The major residue in both urine and feces was the parent compound. Approximately 2% of the oral dose was metabolized and excreted as CL 288511 (1-hydroxy ethyl derivative of imazethapyr). A high percentage of the administered material was excreted in the urine as the unmodified parent compound (> 97%) and a very small amount as CL 288511. In the high dose group, the unmodified parent compound was the major fecal component in both sexes, particularly at 12 hours or less. CL 288511 was the major metabolite. One unknown metabolite was also found in significant quantities. In the low dose group, six components were found in the feces: parent compound, CL 288511, the unknown previously mentioned and three minor unknowns.

Rapidly metabolized in non-susceptible plants (50% loss in soyabeans in 1.6 days).

MeSH Pharmacological ClassificationPesticides used to destroy unwanted vegetation, especially various types of weeds, grasses (POACEAE), and woody plants. Some plants develop HERBICIDE RESISTANCE.
Absorption, Distribution and ExcretionIn rats, following oral administration, 92% was excreted in the urine and 5% in the feces within 24 hr. Residue levels in blood, liver, kidney, muscle, and fat tissues were <0.01 ppm after 48 hr.

Uses & manufacturing

Related reactions

7 records
New reaction record
HRID 290871 reaction equation
HRID 290871As productTraining data from https://doi.org/10.1039/C8SC04228D (8/10)
HRID 307872 reaction equation
HRID 307872As productTraining data from https://doi.org/10.1039/C8SC04228D (8/10)
HRID 1029780 reaction equation
HRID 1029780As productuspto-grants-1992_04
HRID 1032822 reaction equation
HRID 1032822As productuspto-grants-1990_09
HRID 1087270 reaction equation
HRID 1087270As productuspto-grants-1991_07
HRID 1654457 reaction equation
HRID 1654457As reactantuspto-grants-1995_04
HRID 1723472 reaction equation
HRID 1723472As productuspto-grants-1989_08

Compound notes

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On this pageBasic informationOverviewNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Stability/Shelf LifeRapidly degraded in sunlight, DT50 about 2.1 days (pH 7, 22-24 °C)
Dissociation ConstantspK1 = 2.1; pK2 = 3.9
Collision Cross Section184.4 Ų [M+Na]+ [CCS Type: DT; Buffer gas: N2; Ionization: ESI+; Dataset: TOXCAST; Source Identifier: DTXSID3024287]
Other Experimental PropertiesClear dark brown or green liquid; musty odor /Pursuit/

Physicochemical properties

Melting point
169 · 169-173°C
Boiling point
431.49 °C · 431.49°C (rough estimate)
Density
1.1302 · 1.1302 (rough estimate)
refractive index
1.56 · 1.5600 (estimate)
storage temp.
2 · Sealed in dry,2-8°C
solubility
83.33 mg/mL · DMSO: 83.33 mg/mL (288.01 mM)
form
Solid
pka
1 · pK1 2.1; pK2 3.9(at 25℃)
color
White to light yellow
BRN
7437150 · 7437150
Henry's Law Constant
9.9 · 9.9×1010 mol/(m3Pa) at 25℃, HSDB (2015)
Major Application
agricultureenvironmental
InChI
1S/C15H19N3O3/c1-5-9-6-10(13(19)20)11(16-7-9)12-17-14(21)15(4,18-12)8(2)3/h6-8H,5H2,1-4H3,(H,19,20)(H,17,18,21)
InChIKey
XVOKUMIPKHGGTN-UHFFFAOYSA-N
SMILES
CCc1cnc(C2=NC(C)(C(C)C)C(=O)N2)c(c1)C(O)=O
CAS DataBase Reference
81335 · 81335-77-5(CAS DataBase Reference)
FDA UNII
72 T2IN94I4 · 72T2IN94I4
EPA Substance Registry System
Imazethapyr (81335-77-5)
UNSPSC Code
41116107 · 41116107
NACRES
24 · NA.24
Symbol(GHS)
9 · GHS09
Signal word
Warning
Hazard statements
410 · H410-H400
Precautionary statements
273 · P273-P391-P501-P273-P391-P501
PPE
95 · Eyeshields, Gloves, type N95 (US)
WGK Germany
1 · 1
RTECS
5682900 · US5682900
HS Code
29333990 · 29333990
Storage Class
11 · 11 - Combustible Solids
Hazardous Substances Data
81335 · 81335-77-5(Hazardous Substances Data)
Toxicity
50 orally · LD50 orally in rats and mice: >5000 mg/kg; dermally in rabbits: >2000 mg/kg (Peoples)
REACH Registrations
Active

A tolerance is established for the sum of residues of the herbicide imazethapyr, 2-[4,5-dihydro-4-methyl-4-(1-methylethyl)-5-oxo- 1H-imidazol-2-yl]-5-ethyl-3-pyridine carboxylic acid, and its metabolite CL 288511, 2-[4,5-dihydro-4-methyl-4-(1-methylethyl)-5- oxo-1H-imidazol-2-yl]-5-(1-hydroxyethyl)-3-pyridine carboxylic acid, applied as its acid or ammonium salt, in or on the following commodities: [Table#6176]

Tolerances with regional registration, as defined in part 180.1(m) of this chapter, are established for the sum of residues of the herbicide imazethapyr, 2- [4,5-dihydro-4-methyl-4-(1-methylethyl)-5-oxo-1H-imidazol-2-yl]-5-ethyl- 3-pyridine carboxylic acid, as its ammonium salt, and its metabolite, 2- [4,5-dihydro-4-methyl-4-(1-methylethyl)-5-oxo-1H-imidazol-2-yl]-5-(1- hydroxyethyl)-3-pyridine carboxylic acid, both free and conjugated, applied as its acid or ammonium salt, in or on the following raw agricultural commodities: [Table#6177]

New Active Ingredients ... includes chemicals not previously registered as pesticides, as well as pesticide active ingredients initially registered after November 1, 1984 and that currently have active product registrations. By law, these pesticides must meet new safety standards, such as those described in the Food Quality Protection Act of 1996 and, if new safety standards are met, will be reviewed again on a 15-year cycle. Imazethapyr is designated by EPA as a New Pesticide Active Ingredient. Active Ingredient Number: 128922; Type of Pesticide: conventional - herbicide; Use Site: food use turf, rights of way; Year: 1989.

Hazard Classes and CategoriesAcute Tox. 4 (20.7%)

Safety & protection

Storage ConditionsDo not store at <32 °F. Do not contaminate water, food, or feed by storage or disposal.
Disposal Methods · 3 items

SRP: The most favorable course of action is to use an alternative chemical product with less inherent propensity for occupational harm/injury/toxicity or environmental contamination. Recycle any unused portion of the material for its approved use or return it to the manufacturer or supplier. Ultimate disposal of the chemical must consider: the material's impact on air quality; potential migration in soil or water; effects on animal and plant life; and conformance with environmental and public health regulations.

SRP: Wastewater from contaminant suppression, cleaning of protective clothing/equipment, or contaminated sites should be contained and evaluated for subject chemical or decomposition product concentrations. Concentrations shall be lower than applicable environmental discharge or disposal criteria. Alternatively, pretreatment and/or discharge to a permitted wastewater treatment facility is acceptable only after review by the governing authority and assurance that "pass through" violations will not occur. Due consideration shall be given to remediation worker exposure (inhalation, dermal and ingestion) as well as fate during treatment, transfer and disposal. If it is not practicable to manage the chemical in this fashion, it must be evaluated in accordance with EPA 40 CFR Part 261, specifically Subpart B, in order to determine the appropriate local, state and federal requirements for disposal.

Container disposal: triple rinse, then offer for recycling or reconditioning or puncture and dispose of in a sanitary landfill or incineration or, if allowed by state and local authorities, by burning. If burned, stay out of smoke.

Preventive Measures · 3 items

SRP: Contaminated protective clothing should be segregated in such a manner so that there is no direct personal contact by personnel who handle, dispose, or clean the clothing. The completeness of the cleaning procedures should be considered before the decontaminated protective clothing is returned for reuse by the workers. Contaminated clothing should not be taken home at the end of shift, but should remain at employee's place of work for cleaning.

Avoid skin, eye, clothing contact. Wash contaminated clothing with soap and hot water. Do not breathe spray mist.

For several good reasons, .... herbicides ... should be handled and applied only with full attention to safety measures that minimize personal contact. Many formulations contain adjuvants (stabilizers, penetrants, surfactants) that may have significant irritating and toxic effects. A number of premixed formulations contain two or more active ingredients; the companion pesticides may be more toxic than the principal herbicide. Good hygienic practice should not be disregarded just because a pesticide is reported to have a high LD50 in laboratory rodents. /Herbicides/

Allowable Tolerances · 4 items

Tolerances are established for residues of the herbicide imazethapyr, 2-[4,5-dihydro-4-methyl-4-(1-methylethyl)-5-oxo- 1H-imidazol-2-yl]-5-ethyl-3-pyridine carboxylic acid, applied as its acid or ammonium salt, in or on the following raw agricultural commodities: [Table#6170]

Tolerances are established for the sum of the residues of the herbicide imazethapyr, 2-[4,5-dihydro-4-methyl-4-(1-methylethyl)-5-oxo- 1H-imidazol-2-yl]-5-ethyl-3-pyridine carboxylic acid; its metabolite CL 288511, 2-[4,5-dihydro-4-methyl-4-(1-methylethyl)-5-oxo-1H-imidazol-2-yl]-5-(1-hydroxyethyl)-3-pyridine carboxylic acid; and its metabolite CL 182704, 5-[1-(beta-D-glucopyranosyloxy)ethyl]-2-[4,5-dihydro-4-methyl-4-(1-methylethyl)-5-oxo-1H-imidazol-2-yl]-3-pyridinecarboxylic acid, applied as its acid or ammonium salt, in or on the following commodities: [Table#6171]

A tolerance is established for the sum of residues of the herbicide imazethapyr, 2-[4,5-dihydro-4-methyl-4-(1-methylethyl)-5-oxo- 1H-imidazol-2-yl]-5-ethyl-3-pyridine carboxylic acid, and its metabolite CL 288511, 2-[4,5-dihydro-4-methyl-4-(1-methylethyl)-5- oxo-1H-imidazol-2-yl]-5-(1-hydroxyethyl)-3-pyridine carboxylic acid, applied as its acid or ammonium salt, in or on the following commodities: [Table#6172]

Tolerances with regional registration, as defined in part 180.1(m) of this chapter, are established for the sum of residues of the herbicide imazethapyr, 2- [4,5-dihydro-4-methyl-4-(1-methylethyl)-5-oxo-1H-imidazol-2-yl]-5-ethyl- 3-pyridine carboxylic acid, as its ammonium salt, and its metabolite, 2- [4,5-dihydro-4-methyl-4-(1-methylethyl)-5-oxo-1H-imidazol-2-yl]-5-(1- hydroxyethyl)-3-pyridine carboxylic acid, both free and conjugated, applied as its acid or ammonium salt, in or on the following raw agricultural commodities: [Table#6173]

Toxicology

Target OrgansHematologic
Ecotoxicity Values · 5 items

LD50; Species: Colinus virginianus (Bobwhite quail) oral >2150 mg/kg

LD50; Species: Anas platyrhynchos (Mallard) oral >2150 mg/kg

LC50; Species: Lepomis macrochirus (Bluegill); Concentration: 420 mg/L for 96 hr /Conditions of bioassay not specified/

LC50; Species: Onchorhynchus mykiss (Rainbow trout); Concentration: 340 mg/L for 96 hr /Conditions of bioassay not specified/

For more Ecotoxicity Values (Complete) data for IMAZETHAPYR (13 total), please visit the HSDB record page.

Environmental Fate · 4 items

TERRESTRIAL FATE: Based on a classification scheme(1), Koc values of 1.4 to 173(2-5), indicate that imazethapyr is expected to have very high to moderate mobility in soil(SRC). The pKa2 of imazethapyr is 3.9(6), indicating that this compound exists almost entirely in anion form in the environment and anions generally do not adsorb more strongly to soils containing organic carbon and clay than their neutral counterparts(7). Volatilization of imazethapyr from moist soil surfaces is not expected to be an important fate process(SRC) given an estimated Henry's Law constant of 1.0X10-16 atm-cu m/mole(SRC), using a fragment constant estimation method(8). Although low amounts of imazethapyr have evaporated from dry soil(9), volatilization is not expected based upon its very low estimated vapor pressure of 2.1X10-11 mm Hg at 25 °C(SRC), determined from a fragment constant method(10). Imazethapyr has been shown to biodegrade under aerobic conditions with biodegradation half-lives of 23.5 days(11) to 10.6 months(12). Photo decomposition of 14C-imazethapyr from Taloka silt loam, irradiated with sunlight between 8:00 am and 5:00 pm from June 26 thru July 5th was 8% for 43 hours, chain labeled degraded more than ring labeled imazethapyr(9).

TERRESTRIAL FATE: In a two year (1987-1988) field study, imazethapyr was applied to two soil types at pre-plant and pre-emergence times and plots were tilled with conventional and reduced conditions(1). Dissipation half-lives were 49 to 122 days, this included all environmental factors (volatilization, leaching, surface runoff, plant uptake and degradation)(1). Two test fields established in 1991 were treated with imazethapyr both pre-emergence and post-emergence(2). Pre-emergence and post-emergence half-lives were 47 and 19 days for Prince Edward Island site (60% sand, 29% silt, 11% clay, 2.9% organic matter, pH 5.8), and 63 and 34 days for Nova Scotia site (57% sand, 34% silt, 9% clay, 3.3% organic matter, pH 5.8), respectively(2).

AQUATIC FATE: Based on a classification scheme(1), Koc values of 1.4 to 173(2-5), indicate that imazethapyr is expected to adsorb to suspended solids and sediment(SRC). A pKa2 of 3.9(6) indicates imazethapyr will exist almost entirely in the anion form at pH values of 5 to 9 and therefore volatilization from water surfaces is not expected to be an important fate process(SRC). According to a classification scheme(7), an estimated BCF of 3(SRC), from an estimated log Kow of 1.49(6) and a regression-derived equation(8), suggests the potential for bioconcentration in aquatic organisms is low(SRC). Imazethapyr has been reported to biodegrade in soil under aerobic conditions with half-lives of 23.5 days(9) to 10.6 months(10). Imazethapyr had measured aqueous photodegradation half-lives of 4.0 to 5.1 hours in 3 rice paddy waters collected from Beaumont and Eagle Lake, TX and Clarksdale, MS(11).

ATMOSPHERIC FATE: According to a model of gas/particle partitioning of semivolatile organic compounds in the atmosphere(1), imazethapyr, which has an estimated vapor pressure of 2.3X10-11 mm Hg at 25 °C(SRC), determined from a fragment constant method(2), is expected to exist solely in the particulate phase in the ambient atmosphere. Particulate-phase imazethapyr may be removed from the air by wet or dry deposition(SRC).

Adverse EffectsNeurotoxin - Other CNS neurotoxin
Ecotoxicity Excerpts · 2 items

/AQUATIC SPECIES/ Cyprinus carpio was exposed to imazethapyr and imazapic at laboratory and at field conditions. The laboratory experiment was carried out for 7 days and at rice field for 7, 30 and 90 days. Oxidative stress parameters and antioxidant profile were studied as well as metabolic parameters. After 7 days, brain AChE activity increases in laboratory and field, but in muscle, reduction was observed only in laboratory. At the same period, brain and muscle TBARS and liver CAT increase in the laboratory. Metabolic parameters showed changes in both conditions and exposure periods. After 30 days in rice field, brain AChE activity decreases and in muscle it was enhanced. After 90 days in field, only muscle AChE activity was reduced. The disorders in oxidative stress parameters and metabolism remained, indicating mainly a protein catabolism.

/OTHER TERRESTRIAL SPECIES/ Imazethapyr is a member of the imidazolinone class of herbicides. These chemicals are active through inhibition of acetohydroxyacid synthase (AHAS) which is involved in amino acid synthesis (leucine, isoleucine, and valine). The inhibition causes a disruption in protein synthesis that leads to an interference in cell growth.

EPA IRIS Information · 3 items

Pursuit

Hematologic

2.5 x 10 ^-1 mg/kg-day

Soil Adsorption/Mobility · 1 item

Imazethapyr had a reported mean Koc of 13.2 (range of 2 to 55) in 101 allophanic and non-allophanic surface soil samples collected throughout New Zealand(1). Imazethapyr had a reported Koc of 19 at pH 7.7 and an increased Koc of 163 as the pH was reduced to 5.4(2). Imazethapyr has a reported Koc range of 75 to 173(3). Koc values for Trani (55.1% sand, 22.0% silt, 22.9% clay, pH 7.5, organic carbon 1.46%) and Andria (69.1% sand, 18% silt, 12.9% clay, pH 7.8, organic carbon 0.62%) soils were 1.4 and 12.9, respectively(4). According to a classification scheme(5), these reported Koc values suggest that imazethapyr is expected to have very high to moderate mobility in soil. In an adsorption study using 2 humic acids, no measurable adsorption of imazethapyr occurred at pH 4.7, while at pH 3.6 and 3.7, the compound did adsorb(6). The pKa2, 3.9, indicates that at the lower pH values, about half of the amount of herbicide would exist in the molecular form and most of the carboxyl groups of humic acids are combined(6); at pH 4.7, the herbicide is mainly in the ionic form and most of the carboxyl groups of humic acids are also ionized(6). Using 10 soils, Kd values ranging from no detectable adsorption (pH 7.5, % organic carbon 0.86-1.39) to 14.74 (pH 4.5, % organic carbon 11.66) were obtained(6).

Artificial Pollution SourcesImazethapyr's production may result in its release to the environment through various waste streams; its use as a herbicide(1) will result in its direct release to the environment(SRC).
Environmental Biodegradation · 2 items

Little anaerobic biodegradation was reported in soil and sediment(1). Aerobic field soil half-lives of 53 to 122 days were reported(1).

AEROBIC: 14C Radio-labeled imazethapyr was incubated for 12 weeks at 28 °C in the dark in two soil types; Drummer silty loam (9% sand, 57% silt, 34% clay, pH 5.7, 5.8% organic carbon) and Cisne silt (14% sand, 74% silt, 12% clay, pH 7.0, 1.3% organic carbon)(1). Imazethapyr was biodegraded 18.2 and 26.8% in Drummer loam when 14C labeled on the carboxyl group and ring structure, respectively(1). Imazethapyr was biodegraded 46.9 and 53.5% in Cisne silt when 14C labeled on the carboxyl group and ring structure, respectively(1). Maury silt loam (8% sand, 67% silt, 25% clay, 2.6% organic matter, pH 6.3) was used in an 8 week study with radio-labeled 14C imazethapyr to determine effects of temperature and moisture on biodegradation(2). 14CO2 evolution from soil incubated at 15 and 30 °C was 1.5 and 4.4% for ring labeled imazethapyr and 2.0 and 5.4% for carboxyl labeled imazethapyr, respectively(2). 14CO2 evolution from ring labeled imazethapyr was 1.1, 3.4, 4.3, 5.4 and 4.6% at 15, 25, 50, 75 and 100% field capacity water content, respectively(2). Biodegradation half-lives of 14C-labeled imazethapyr were 2.6 to 9.0 months for Taloka silt loam (23% sand, 62% silt, 15% clay, 1.7% organic matter, pH 6.3) and 6.4 to 10.6 months for Sharkey silty clay (9% sand, 40% silt, 51% clay, 2.4% organic matter, pH 6.7)(3). Aerobic biodegradation rates were measured in six soils with a range of physico-chemical properties, incubation time was 60 days in the dark at 25 °C and 50% moisture(4). Half-lives were 23.5 to 62.2 days(4). Biodegradation half-lives for imazethapyr in soil are reported as 72.94 to 257.28 days under 33 to 75% field capacity moisture, 10 to 20 °C incubation temperature and 0.1 to 10 ppm initial concentration(5).

Environmental Bioconcentration · 1 item

An estimated BCF of 3 was calculated in fish for imazethapyr(SRC), using a log Kow of 1.49(1) and a regression-derived equation(2). According to a classification scheme(3), this BCF suggests the potential for bioconcentration in aquatic organisms is low(SRC).

Volatilization from Water/Soil · 1 item

A pKa2 of 3.9(1) indicates imazethapyr will exist almost entirely in the anion form at pH values of 5 to 9 and therefore volatilization from water surfaces is not expected to be an important fate process(SRC). Volatilization of imazethapyr from moist soil surfaces is not expected to be an important fate process(SRC) given an estimated Henry's Law constant of 1.0X10-16 atm-cu m/mole(SRC), calculated using a fragment constant estimation method(2). Volatilization of 14C radio-labeled imazethapyr (ring and chain labeled) from dry soil was 1.5% from Taloka silt loam (23% sand, 62% silt, 15% clay, 1.7% organic matter, pH 6.3) and 1.0% from Sharkey silty clay (9% sand, 40% silt, 51% clay, 2.4% organic matter, pH 6.7), soil was incubated at 49 °C for a maximum of 168 hours(3); these values are very low(SRC). Volatilization is not expected based upon its very low estimated vapor pressure of 2.1X10-11 mm Hg at 25 °C(SRC), determined from a fragment constant method(4).

Non-Human Toxicity Excerpts · 5 items

/LABORATORY ANIMALS: Subchronic or Prechronic Exposure/ In 28 days feeding trials, no effect level for rats was 10,000 mg/kg (highest dose tested).

/LABORATORY ANIMALS: Chronic Exposure or Carcinogenicity/ A 1-year feeding study in dogs fed diets containing 0, 1,000, 5,000, or 10,000 ppm with a NOEL of 1,000 ppm (25 mg/kg/day and a LOEL of 5,000 ppm (125 mg/kg/day), based on decreased packed cell volume, hemoglobin, and erythrocytes in females.

/LABORATORY ANIMALS: Chronic Exposure or Carcinogenicity/ A 2-year chronic toxicity/ carcinogenicity study in rats fed diets containing 0, 1,000, 5,000, or 10,000 ppm with no carcinogenic effects observed under the conditions of the study at levels up to and including 10,000 ppm (500 mg/kg/day [HDT]) and a systemic NOEL of 10,000 ppm (500 mg/kg/day (HDT)).

/LABORATORY ANIMALS: Chronic Exposure or Carcinogenicity/ An 18-month carcinogenicity study with mice fed diets containing 0, 1,000, 5,000, or 10,000 ppm with no carcinogenic effects observed under the conditions of the study at levels up to and including 10,000 ppm (1,500 mg/ kg/day) (highest dose tested [HDT]), a systemic no-observed-effect level (NOEL) of 5,000 ppm (750 mg/kg/day), and a systemic LOEL of 10,000 ppm (1,500 mg/kg/day), based on decreased body weight gain in both sexes.

For more Non-Human Toxicity Excerpts (Complete) data for IMAZETHAPYR (9 total), please visit the HSDB record page.

Regulatory information

FIFRA Requirements · 5 items

Tolerances are established for residues of the herbicide imazethapyr, 2-[4,5-dihydro-4-methyl-4-(1-methylethyl)-5-oxo- 1H-imidazol-2-yl]-5-ethyl-3-pyridine carboxylic acid, applied as its acid or ammonium salt, in or on the following raw agricultural commodities: [Table#6174]

Tolerances are established for the sum of the residues of the herbicide imazethapyr, 2-[4,5-dihydro-4-methyl-4-(1-methylethyl)-5-oxo- 1H-imidazol-2-yl]-5-ethyl-3-pyridine carboxylic acid; its metabolite CL 288511, 2-[4,5-dihydro-4-methyl-4-(1-methylethyl)-5-oxo-1H-imidazol-2-yl]-5-(1-hydroxyethyl)-3-pyridine carboxylic acid; and its metabolite CL 182704, 5-[1-(beta-D-glucopyranosyloxy)ethyl]-2-[4,5-dihydro-4-methyl-4-(1-methylethyl)-5-oxo-1H-imidazol-2-yl]-3-pyridinecarboxylic acid, applied as its acid or ammonium salt, in or on the following commodities: [Table#6175]

A tolerance is established for the sum of residues of the herbicide imazethapyr, 2-[4,5-dihydro-4-methyl-4-(1-methylethyl)-5-oxo- 1H-imidazol-2-yl]-5-ethyl-3-pyridine carboxylic acid, and its metabolite CL 288511, 2-[4,5-dihydro-4-methyl-4-(1-methylethyl)-5- oxo-1H-imidazol-2-yl]-5-(1-hydroxyethyl)-3-pyridine carboxylic acid, applied as its acid or ammonium salt, in or on the following commodities: [Table#6176]

Tolerances with regional registration, as defined in part 180.1(m) of this chapter, are established for the sum of residues of the herbicide imazethapyr, 2- [4,5-dihydro-4-methyl-4-(1-methylethyl)-5-oxo-1H-imidazol-2-yl]-5-ethyl- 3-pyridine carboxylic acid, as its ammonium salt, and its metabolite, 2- [4,5-dihydro-4-methyl-4-(1-methylethyl)-5-oxo-1H-imidazol-2-yl]-5-(1- hydroxyethyl)-3-pyridine carboxylic acid, both free and conjugated, applied as its acid or ammonium salt, in or on the following raw agricultural commodities: [Table#6177]

New Active Ingredients ... includes chemicals not previously registered as pesticides, as well as pesticide active ingredients initially registered after November 1, 1984 and that currently have active product registrations. By law, these pesticides must meet new safety standards, such as those described in the Food Quality Protection Act of 1996 and, if new safety standards are met, will be reviewed again on a 15-year cycle. Imazethapyr is designated by EPA as a New Pesticide Active Ingredient. Active Ingredient Number: 128922; Type of Pesticide: conventional - herbicide; Use Site: food use turf, rights of way; Year: 1989.

Safety data

PPE
Eyeshields, Gloves, type N95 (US)
wgk
1
rtecs
US5682900
hs_code
29333990
Toxicity
LD50 orally in rats and mice: >5000 mg/kg; dermally in rabbits: >2000 mg/kg (Peoples)
Signal word
Warning
Symbol(GHS)
GHS09
Storage Class
11 - Combustible Solids
Hazard statements
H410-H400
REACH Registrations
Active
Precautionary statements
P273-P391-P501-P273-P391-P501
Hazardous Substances Data
81335-77-5(Hazardous Substances Data)
Uses · 5 items

Selective imidazolinone herbicide; [Merck Index] Used to control annual and perennial grasses and broad-leaved weeds in soy beans; [HSDB]

Farming (Pesticides) [Category: Industry]

For imazethapyr (USEPA/OPP Pesticide Code: 128922) ACTIVE products with label matches. /SRP: Registered for use in the U.S. but approved pesticide uses may change periodically and so federal, state and local authorities must be consulted for currently approved uses./

Herbicide

Control of many major annual and perennial grass and broad leaved weeds in most major crops ... Applied pre-plant incorporated, pre-emergence, or post-emergence.

Methods of ManufacturingImazethapyr is produced by reaction of 2,3- dicarboxymethyl-5-ethylpyridine with 2-aminoamide- 3-methylbutane in the presence of two equivalents of tert-butoxide.
Formulations/Preparations · 5 items

Premix Partners: Atrazine; Dicamba; Glyphosate; Imazapyr; Imazaquin; Pendimethalin; Saflufenacil; Sulfentrazone; Trifluralin.

Aqueous concentrate

Pursuit Herbicide Technical (Basf Corporation) Imazethapyr 97.3%

Pursuit Plus EC Herbicide (Basf Corporation) Pendimethalin 30.24%, Imazethapyr 2.24%

For more Formulations/Preparations (Complete) data for IMAZETHAPYR (23 total), please visit the HSDB record page.

General Manufacturing InformationThe WHO Recommended Classification of Pesticides by Hazard identifies imazethapyr as unlikely to present an acute hazard in normal use; Main Use: herbicide.

Applications

UsesImazethapyr is a herbicide that that is used in biological studies to evaluate the effect on non-target vegetation within agroecosystems.

Preparation methods · 1 item

PreparationDiketene is treated with chlorine in the dichloromethane to extract the chloroacetic acid ethyl ester. The compound is reacted with methylene chloride at room temperature for 10 hours to give 2, 4-dichloroacetoacetate. Reflux 2-ethylacrolein and ammonium sulfamate in absolute ethanol for 1.5 hours to give ethyl 2-chloromethyl-ethyl nicotinate, which is further reacted with 2-amino-2,3-bis Methyl butyramide and sodium bicarbonate in dimethyl sulfoxide at 80 ℃ for 6h, the resulting condensation product was hydrolyzed and then cyclized in acetic acid to produce imazethapyr. 2, 3-pyridinedicarboxylic acid is reacted with acetic anhydride in toluene to produce pyridine dianhydride, which is then reacted with (CH3) 2CHCOH3 (CN) NH2 at 10-12 ° C to form carbamoyl nicotinic acid. Apply hydrogen peroxide in sodium hydroxide solution for hydrolysis, and finally heat to 70 ℃ for cyclization reaction, that is, imazapyr.

Upstream & downstream products

Upstream raw materials

Ethyl acetoacetateAcetyl keteneEthyl nicotinate2-EthylacrylaldehydeChloroacetylAD-67 Antidote5-Ethyl-2-(4-isopropyl-4-methyl-5-oxo-1H-imidazolin-2-yl)nicotinic acidAmmonium sulfamateButyramideTriethanolamine

Additional notes

DefinitionChEBI: Imazethapyr is an aromatic carboxylic acid and a member of pyridines.