Propylamine

HCID 7852CAS 107-10-8

Basic information

Standard SMILES
CCCN
InChIKey
WGYKZJWCGVVSQN-UHFFFAOYSA-N
Molecular formula
C3H9N
Average molar mass
59.11 g/mol
Monoisotopic mass
59.07349929

Overview

Propylamine appears as a clear colorless liquid with an ammonia-like odor. Flash point -35 °F. Less dense than water and soluble in water. Vapors are heavier than air. Produces toxic oxides of nitrogen during combustion. Used in chemical analysis and to make other chemicals.

Names & identifiers

Preferred name
Propylamine
IUPAC
propan-1-amine
English name
Propylamine
Molecular formula
C3H9N
Molecular weight
59.11

Names & synonyms

PropylaminePropan-1-amine107-10-81-PropylaminePropanamine1-AMINOPROPANEMono-n-propylamineMonopropylamineRCRA waste number U194Propan-1-ylamineNSC 7490(n-Propan-1-yl)amine
Show more names
PAN-PROPYLAMINEMNPAPropylamin1-PROPANAMINEn-Propylaminwe
HSDB 5162EINECS 203-462-3UNII-I76F18D635AI3-26456NSC-7490I76F18D635DTXSID6021878FEMA NO. 4237

Database identifiers

CAS
107-10-8
PubChem CID
7852
DTXSID
DTXSID6021878
ChEMBL
CHEMBL14409
ChEBI
CHEBI:39870
UNII
I76F18D635
EC Number
203-462-3
Nikkaji
J4.052E

Properties

Computed structural properties

XLogP
0.5
Topological polar surface area
26 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
1
Rotatable bonds
1
Heavy atoms
4

Experimental & physicochemical properties

Chemical Classes · 2 items

Nitrogen Compounds -> Amines, Aliphatic

Flammable agents - 3rd degree

pHAlkaline
SpringerMaterials PropertiesBoiling point
LogP · 3 items

log Kow = 0.48

0.48

0.15

OdorStrong ammonia odor
Food AdditivesFLAVORING AGENT OR ADJUVANT -> FDA Substance added to food

Physicochemical properties

Melting point
-83 °C · -83 °C (lit.)
Boiling point
48 °C · 48 °C (lit.)
Density
0.719 g/mL · 0.719 g/mL at 25 °C (lit.)
vapor density
2 · 2 (vs air)
vapor pressure
4.79 psi · 4.79 psi ( 20 °C)
refractive index
20 · n20/D 1.388(lit.)

Safety & regulation

GHS classification

GHS Classification · 6 items

Danger

H225 (99.5%): Highly Flammable liquid and vapor [Danger Flammable liquids]

P210, P233, P234, P240, P241, P242, P243, P260, P261, P262, P264, P264+P265, P270, P271, P273, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P317, P319, P321, P330, P361+P364, P363, P370+P378, P390, P403+P233, P403+P235, P405, P406, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 182 reports by companies from 14 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Danger

H225: Highly Flammable liquid and vapor [Danger Flammable liquids]

Hazard information

Regulatory Information · 6 items

Chemical: 1-Propanamine

Commission Regulation (EC) No 1565/2000 (Repealed by Com. Implementing Reg. (EU) No 872/2012)

1-Propanamine is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 1-Propanamine are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)

Status: Active Update: 25-04-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/1998

1-Propanamine: HSNO Approval: HSR001261 Approved with controls

The New Jersey Worker and Community Right to Know Act requires public and private employers to provide information about hazardous substances at their workplaces. (N.J.S.A. 34:5A-1 et. seq.)

DOT LabelFlammable Liquid Corrosive
Fire Hazards · 3 items

Special Hazards of Combustion Products: Extreme danger, enter with great care. Thermal decomposition may produce nitrogen oxides, CO and/or CO2.

· Flammable/combustible material.

Highly flammable. Gives off irritating or toxic fumes (or gases) in a fire. Vapour/air mixtures are explosive.

Fire PotentialFLAMMABLE LIQUID.
Health Hazards · 2 items

INHALATION: Mucous membrane and respiratory tract irritation. Tracheitis, bronchitis, pneumonitis, and pulmonary edema. EYES: Severe corneal damage or complete eye destruction. SKIN: Single drop-deep necrosis. INGESTION: Corrosive to G.I. tract. (USCG, 1999)

· May cause toxic effects if inhaled or ingested.

Hazards Summary · 1 item

Animals exposed to lethal concentrations have dyspnea and hepatitis. [ChemIDplus] Corrosive to the skin, eyes, and respiratory tract; Can cause pulmonary edema at high concentrations; [NJ-HSFS] Liquid may cause second or third degree burns after brief skin contact. [CHRIS] May cause halo vision at lower concentrations; [CHEMINFO]

Safety & protection

Fire Fighting · 2 items

Excerpt from ERG Guide 132 [Flammable Liquids - Corrosive]:

Use powder, alcohol-resistant foam, water in large amounts, carbon dioxide. In case of fire: keep drums, etc., cool by spraying with water.

First Aid Measures · 4 items

Fresh air, rest. Half-upright position. Refer immediately for medical attention.

First rinse with plenty of water for at least 15 minutes, then remove contaminated clothes and rinse again. Refer immediately for medical attention.

Rinse with plenty of water (remove contact lenses if easily possible). Refer immediately for medical attention.

Rinse mouth. Do NOT induce vomiting. Refer immediately for medical attention.

Accidental Release Measures · 2 items

· CALL 911. Then call emergency response telephone number on shipping paper. If shipping paper not available or no answer, refer to appropriate telephone number listed on the inside back cover.

· ELIMINATE all ignition sources (no smoking, flares, sparks or flames) from immediate area.

First Aid · 2 items

Call a physician.

General First Aid:

Safe StorageProvision to contain effluent from fire extinguishing. Fireproof. Separated from strong oxidants, strong acids and food and feedstuffs. Dry. Well closed. Store in an area without drain or sewer access.
Firefighting HazardsVAPOR IS HEAVIER THAN AIR ... & MAY TRAVEL A CONSIDERABLE DISTANCE TO SOURCE OF IGNITION & FLASH BACK.

Toxicology

Ecotoxicity Values · 5 items

EC50; Species: Anabaena subcylindrica (Blue-green algae, axenic, 1-3x 10+7 cells/mL); Conditions: freshwater, static, 25 °C, pH 7.2; Concentration: 0.012 ug/cell for < or = 3 hr; Effect: decreased nitrogen fixation

EC50; Species: Anabaena subcylindrica (Blue-green algae, axenic, 1-3x 10+7 cells/mL); Conditions: freshwater, static, 25 °C, pH 7.2; Concentration: 1.8x10-8 ug/cell for < or = 3 hr; Effect: photosynthesis, oxygen production

EC50; Species: Chlorella ellipsoidea (Green algae, axenic); Conditions: freshwater, static, 25 °C, pH 7.2; Concentration: 0.4x10-8 ug/cell for 90 min; Effect: photosynthesis, oxygen production

EC50; Species: Daphnia magna (Water flea, Lake Langedam strain, age <24 hr); Conditions: freshwater, static, 20 °C, pH 7.8-8.0, hardness 250 mg/L CaCO3, dissolved oxygen 94-99%; Concentration: 100 mg/L for 24 hr; Effect: intoxication, immobilization

For more Ecotoxicity Values (Complete) data for PROPYLAMINE (7 total), please visit the HSDB record page.

Environmental Fate · 3 items

TERRESTRIAL FATE: Based on a classification scheme(1), an estimated Koc value of 43(SRC), determined from a log Kow of 0.48(2) and a regression-derived equation(3), indicates that propylamine is expected to have very high mobility in soil(SRC). The pKa of propylamine is 10.71(4), indicating that this compound will exist almost entirely in the cation form in the environment and cations generally adsorb more strongly to soils containing organic carbon and clay than their neutral counterparts(5). Volatilization of propylamine from moist soil surfaces is not expected to be an important fate process given its cationic state(SRC). Propylamine is expected to volatilize from dry soil surfaces(SRC) based upon a vapor pressure of 310 mm Hg(6). Biodegradation of propylamine is expected to occur(7-9); a 102% theoretical BOD was measured after 13 days using a non-activated sludge inoculum(7).

AQUATIC FATE: Based on a classification scheme(1), an estimated Koc value of 43(SRC), determined from a log Kow of 0.48(2) and a regression-derived equation(3), indicates that propylamine is not expected to adsorb to suspended solids and sediment(SRC). A pKa of 10.71(4) indicates propylamine will exist almost entirely in the cation form at pH values of 5 to 9 and therefore volatilization from water surfaces is not expected to be an important fate process(5). According to a classification scheme(6), an estimated BCF of 3(SRC), from its log Kow(2) and a regression-derived equation(7), suggests the potential for bioconcentration in aquatic organisms is low(SRC). Biodegradation of propylamine is expected to occur(8-10); a 102% of theoretical BOD was measured after 13 days using a non-activated sludge inoculum(8).

ATMOSPHERIC FATE: According to a model of gas/particle partitioning of semivolatile organic compounds in the atmosphere(1), propylamine, which has a vapor pressure of 310 mm Hg at 25 °C(2), is expected to exist solely as a vapor in the ambient atmosphere. Vapor-phase propylamine is degraded in the atmosphere by reaction with photochemically-produced hydroxyl radicals(SRC); the half-life for this reaction in air is estimated to be 12 hours(SRC), calculated from its rate constant of 3.3X10-11 cu cm/molecule-sec at 25 °C(SRC) that was derived using a structure estimation method(3). Propylamine does not contain chromophores that absorb at wavelengths >290 nm(4) and therefore is not expected to be susceptible to direct photolysis by sunlight(SRC).

Food Survey Values · 1 item

The following naturally occuring concns of propylamine (in mg/kg) were detected in various food products from W Germany: fresh rutabaga, 5.0; paprika, 2.3; paprika brine, 10.6; cucumber, 0.1-7.5; pepperoni, 1.4; pickled onions, 1.8; celery, 2.7; cheese, 2-8.7; brown bread, 1.6; freeze-dried coffee and coffee extract, trace-0.5(1). Propylamine has been qualitatively detected in wine, beer, rice, barley, malt, and corn(2,3).

Adverse EffectsOccupational hepatotoxin - Secondary hepatotoxins: the potential for toxic effect in the occupational setting is based on cases of poisoning by human ingestion or animal experimentation.
Exposure RoutesThe substance can be absorbed into the body by inhalation of its vapour, through the skin and by ingestion. Serious local effects by all routes of exposure.
Milk Concentrations · 1 item

... The presence of volatile aliphatic amines ... in human breast milk and amniotic fluid /was measured/ to assess their role in neonatal hypergastrinemia. These volatile nitrogenous amino acid metabolites have been previously demonstrated to stimulate gastrin release in in vivo and in vitro laboratory preparations. ... The present study ... demonstrated that these gastrin-stimulatory volatile amines were present in significant concentrations in breast milk during the first several weeks after parturition and in amniotic fluid. The individual amines that were identified in both human milk and amniotic fluid samples were methylamine, dimethylamine, ethylamine, trimethylamine, propylamine, isobutylamine, and butylamine. This study provides indirect evidence to support the possibility that the hypergastrinemia measured in the fetus/neonate during the period immediately before and after birth may be attributable, in part, to the ingestion of fluid containing high concentrations of gastrin-stimulating amines.

Regulatory information

RCRA Requirements · 1 item

U194; As stipulated in 40 CFR 261.33, when 1-propanamine, as a commercial chemical product or manufacturing chemical intermediate or an off-specification commercial chemical product or a manufacturing chemical intermediate, becomes a waste, it must be managed according to Federal and/or State hazardous waste regulations. Also defined as a hazardous waste is any residue, contaminated soil, water, or other debris resulting from the cleanup of a spill, into water or on dry land, of this waste. Generators of small quantities of this waste may qualify for partial exclusion from hazardous waste regulations (40 CFR 261.5).

TSCA Requirements · 1 item

Pursuant to section 8(d) of TSCA, EPA promulgated a model Health and Safety Data Reporting Rule. The section 8(d) model rule requires manufacturers, importers, and processors of listed chemical substances and mixtures to submit to EPA copies and lists of unpublished health and safety studies. 1-Propanamine is included on this list.

Atmospheric Standards · 1 item

This action promulgates standards of performance for equipment leaks of Volatile Organic Compounds (VOC) in the Synthetic Organic Chemical Manufacturing Industry (SOCMI). The intended effect of these standards is to require all newly constructed, modified, and reconstructed SOCMI process units to use the best demonstrated system of continuous emission reduction for equipment leaks of VOC, considering costs, non air quality health and environmental impact and energy requirements. Propylamine is produced, as an intermediate or a final product, by process units covered under this subpart.

CERCLA Reportable Quantities · 1 item

Persons in charge of vessels or facilities are required to notify the National Response Center (NRC) immediately, when there is a release of this designated hazardous substance, in an amount equal to or greater than its reportable quantity of 5000 lb or 2270 kg. The toll free number of the NRC is (800) 424-8802. The rule for determining when notification is required is stated in 40 CFR 302.4 (section IV. D.3.b).

Safety data

F
34
PPE
Faceshields, Gloves, Goggles
wgk
1
tsca
TSCA listed
rtecs
UH9100000
ridadr
UN 1277

Chemistry & industry

Pharmacology

Absorption, Distribution and Excretion · 1 item

Sprague-Dawley rats were made acidotic or alkalotic. Intraperitoneal injections of free n-propylamine were given. Urine samples were collected and aliphatic amines, excreted chemicals, and urinary creatinine were measured. Excretion of n-propylamine was significantly higher in acidotic rats.

Cellular LocationsCytoplasm

Uses & manufacturing

Uses · 3 items

Used as a chemical intermediate and laboratory reagent; [Hawley]

Intermediate, lab reagent.

Manufacturing rubber chemicals; dyestuffs; pharmaceuticals; agricultural chemicals; corrosion inhibitors; textile and leather finishing resins

U.S. Exports · 2 items

(1977) No Data

(1979) No Data

U.S. Imports · 2 items

(1977) No Data

(1979) No Data

U.S. Production · 4 items

2023: 50,000 - <250,000 lb

(1975) 2.73X10+8 GRAMS

(1979) PROBABLY GREATER THAN 4.54X10+6 GRAMS

Production volumes for non-confidential chemicals reported under the Inventory Update Rule. [Table#5229]

Consumption PatternsESSENTIALLY 100% AS A CHEMICAL INTERMEDIATE
Industry UsesNot Known or Reasonably Ascertainable
Applications · 3 items

Uses1-Propylamine is used in chemical analysis and to make other chemicals, used as a solvent in organic synthesis. And it is used as finishing agent of drugs, paints, rubber, fiber, textile and resin. Additionally, it can be used as petroleum additive and preservative.

Usesn-Propylamine is used as an intermediate inmany organic reactions. It has been used in the synthesis of single crystals of siliceous ferrierite.

General DescriptionA clear colorless liquid with an ammonia-like odor. Flash point -35°F. Less dense than water and soluble in water. Vapors are heavier than air. Produces toxic oxides of nitrogen during combustion. Used in chemical analysis and to make other chemicals.

Suppliers50 total

国药集团化学试剂有限公司86-21-63210123 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
山东旭晨化工科技有限公司0533-15715337262 15715337262 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
Shandong chuangyingchemical Co., Ltd.18853181302 · [email protected]

Additional notes

DefinitionChEBI: Propylamine is a member of the class of alkylamines that is propane substituted by an amino group at C-1. It is a conjugate base of a propan-1-aminium.

Related reactions

1,356 records

Linked notes

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