Chlorsulfuron

Clean · finesse · TELAR · PRESS · GLEAN · W-4189 · gleanc · LASHER

https://huagongshe.com/ko/chemical/47491

식별자 및 물리적 특성

CAS No.	112143-77-8
분자식	C12H12ClN5O4S
평균 분자량	357.77 g/mol
단동위원소 질량	357.02985254 g/mol
SMILES	COc1nc(C)nc(NC(=O)NS(=O)(=O)c2ccccc2Cl)n1
InChIKey	VJYIFXVZLXQVHO-UHFFFAOYSA-N
PubChem CID	47491
ChEMBL	CHEMBL1229721
ChEBI	CHEBI:3652
EC No.	265-268-5
DTXSID	DTXSID7023980

화학 및 물리적 성질

XLogP	2.3
극성 표면적	132
수소 결합 공여자 수	2
수소 결합 수용자 수	7
회전 가능 결합 수	4
무거운 원자 수	23
형식 전하	0
복잡도	514
농약	Pesticide -> EPA IRISHerbicidesActive substance -> EU Pesticides database: Not approvedPesticides -> Herbicides, SulfonylureaPesticide (Chlorsulfuron) -> USDA PDB
LogP(분배 계수)	log Kow = 0.74 at pH 5 and -1.34 at pH 71.54
냄새	Odorless
Color/Form	White crystalline solidCrystals from ether
용해도	In water, 125 mg/L at 25 °CSolubility (25 °C) : 4 g/L acetone102 g/L dichloromethane, <0.01 g/L hexane, 15 g/L methanol3 g/L tolueneModerately soluble in methylene chlorideless soluble in acetone, acetonitril. Low solubility in hydrocarbon solvents.Slight solubility in methylene chloride, acetone, methanol, toluene, hexane>53.7 [ug/mL] (The mean of the results at pH 7.4)클로로포름(약간 용해됨), DMSO(약간 용해됨), 메탄올(약간 용해됨)
Corrosivity	Non-corrosive
Endocrine Disruptors	Potential endocrine disrupting compound
Decomposition	When heated to decomposition it emits toxic vapors of /nitrogen oxides, sulfur oxides, and chloride/.
녹는점	176 °CMP: 174-178 °C174-178°C
증기압	2.25X10-11 mm Hg at 25 °C0.81313 [mm Hg] @25 °C
헨리 상수	Henry's Law constant = 5X10-10 (pH 5)2.5X10-11 (pH 7)3.2X10-12 (pH 9) (all in Pa-cu m/mol, 20 °C)3.2×104 mol/(m3Pa) at 25℃, Mackay et al. (2006)
Physical Description	Chlorsulfuron appears as colorless crystals. Non corrosive. Insoluble in water. Used as an herbicide.Colorless or white odorless solid[HSDB]
밀도	1.6111 (rough estimate)
굴절률	1.5630 (estimate)
저장 조건	0-6°C
물리적 상태	Solid
pKa(산도 계수)	4.21±0.10(Predicted)
색상	White to off-white
Merck	13,2210
BRN	577255
주요 응용	농업환경
InChI	1S/C12H12ClN5O4S/c1-7-14-10(17-12(15-7)22-2)16-11(19)18-23(20,21)9-6-4-3-5-8(9)13/h3-6H,1-2H3,(H2,14,15,16,17,18,19)
InChIKey	VJYIFXVZLXQVHO-UHFFFAOYSA-N
SMILES	COc1nc(C)nc(NC(=O)NS(=O)(=O)c2ccccc2Cl)n1
NIST	Chlorsulfuron(64902-72-3)
EPA	Chlorsulfuron (64902-72-3)

화학적 성질

Colorless, odorless crystals

안전 및 규제

FIFRA 요건
GHS 분류	WarningH400: Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard]P273, P391, and P501 (click each P-code to see the statement)H400 (100%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard]
규제 정보	Commission Regulation (EC) No 1490/2002Chlorsulfuron is listed in the dataset of EPA Human Health Benchmarks for Pesticides under the Safe Drinking Water Act (40 eCFR 141)2009/77/EC, Reg. (EU) 2022/801, Reg. (EU) No 540/2011Chlorsulfuron: Does not have an individual approval but may be used under an appropriate group standardThe 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.)
기타 안전 정보	IMAP assessments - Benzenesulfonamide, 2-chloro-N-[[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)amino]carbonyl]-: Environment tier I assessment
운송 라벨(DOT)	Class 9
화재 위험	Excerpt from ERG Guide 171 [Substances (Low to Moderate Hazard)]:
건강 유해성	Excerpt from ERG Guide 171 [Substances (Low to Moderate Hazard)]:
유해성 요약	An eye irritant[HSDB] For the triazine herbicides, systemic toxicity unlikely unless large amounts are ingestedMay cause irritation[EPA Pesticides, p. 121]
반응성 그룹	Amides and Imides
Special Reports	USEPA/Office of Prevention, Pesticides and Toxic SubstancesReregistration Eligibility Decision Document - Chlorsulfuron (May 2005). The RED summarizes the risk assessment conclusions and outlines any risk reduction measures necessary for the pesticide to continue to be registered in the USA.[Available from, as of June 20, 2017 http://www.epa.gov/pesticides/reregistration/status.htm]Blair AM, Martin TDPestic Sci 22 (3): 195-220 (1988). A review of the activity fate and mode of action of sulfonylurea herbicides

용도

개요

Chlorsulfuron is one of the first sulfonylurea herbicides developed and commercialized by DuPont. Dr George Levitt and his team at DuPont first synthesized chlorsulfuron in 1976, and it was commercialized for use as a herbicide in 1981. It is currently registered by DuPont in the United States, Canada, the European Union, Russia, the Ukraine, Australia, New Zealand, South Africa, Saudi Arabia, and in several countries of South America. Compared with many other herbicides that are applied at levels of pounds per acre (or kilograms per acre), sulfonylureas are highly effective at use rates of less than an ounce per acre (approximately 6 g per acre for chlorsulfuron).

용도

Chlorsulfuron is used as a postemergence herbicide for the control of dicotyledonous weeds, with excellent safety for wheat and other cereals crops. While chlorsulfuron is primarily used to control weeds in cereals, it can also be used in range and pasture applications. It is currently only used to a minor extent for nonfood industrial applications and right-of-way purposes.

일반 설명

Colorless crystals. Non corrosive. Insoluble in water. Used as an herbicide.