chlorpyrifos-methyl (CHEBI:34632)

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ChEBI Name	chlorpyrifos-methyl

ChEBI ID	CHEBI:34632

Definition	An organic thiophosphate that is O,O-dimethyl hydrogen phosphorothioate in which the hydrogen of the hydroxy group has been replaced by a 3,5,6-trichloropyridin-2-yl group.

Stars	This entity has been manually annotated by the ChEBI Team.

Supplier Information

Download	Molfile XML SDF

Formula

C7H7Cl3NO3PS

Net Charge

Average Mass

322.53328

Monoisotopic Mass

320.89498

InChI

InChI=1S/C7H7Cl3NO3PS/c1-12-15(16,13-2)14-7-5(9)3-4(8)6(10)11-7/h3H,1-2H3

InChIKey

HRBKVYFZANMGRE-UHFFFAOYSA-N

SMILES

COP(=S)(OC)Oc1nc(Cl)c(Cl)cc1Cl

Roles Classification
Chemical Role(s):	environmental contaminant Any minor or unwanted substance introduced into the environment that can have undesired effects.

Biological Role(s):	EC 3.1.1.7 (acetylcholinesterase) inhibitor An EC 3.1.1.* (carboxylic ester hydrolase) inhibitor that interferes with the action of enzyme acetylcholinesterase (EC 3.1.1.7), which helps breaking down of acetylcholine into choline and acetic acid. xenobiotic A xenobiotic (Greek, xenos "foreign"; bios "life") is a compound that is foreign to a living organism. Principal xenobiotics include: drugs, carcinogens and various compounds that have been introduced into the environment by artificial means.

Application(s):	agrochemical An agrochemical is a substance that is used in agriculture or horticulture. acaricide A substance used to destroy pests of the subclass Acari (mites and ticks). insecticide Strictly, a substance intended to kill members of the class Insecta. In common usage, any substance used for preventing, destroying, repelling or controlling insects.

ChEBI Ontology
Outgoing	chlorpyrifos-methyl (CHEBI:34632) has role acaricide (CHEBI:22153) chlorpyrifos-methyl (CHEBI:34632) has role agrochemical (CHEBI:33286) chlorpyrifos-methyl (CHEBI:34632) has role EC 3.1.1.7 (acetylcholinesterase) inhibitor (CHEBI:38462) chlorpyrifos-methyl (CHEBI:34632) has role environmental contaminant (CHEBI:78298) chlorpyrifos-methyl (CHEBI:34632) has role insecticide (CHEBI:24852) chlorpyrifos-methyl (CHEBI:34632) has role xenobiotic (CHEBI:35703) chlorpyrifos-methyl (CHEBI:34632) is a chloropyridine (CHEBI:39173) chlorpyrifos-methyl (CHEBI:34632) is a organic thiophosphate (CHEBI:37512)

IUPAC Name

O,O-dimethyl O-(3,5,6-trichloropyridin-2-yl) phosphorothioate

Synonyms	Sources
Chloropyriphos-methyl	KEGG COMPOUND
Chlorpyrifos O,O-dimethyl analog	ChemIDplus
Chlorpyrifos-methyl	KEGG COMPOUND
Methyl chlorpyrifos	ChemIDplus
Methyl chlorpyriphos	ChemIDplus
O,O-Dimethyl O-(3,5,6-trichloro-2-pyridyl) phosphorothioate	ChemIDplus
O,O-dimethyl O-(3,5,6-trichloropyridin-2-yl) thiophosphate	IUPAC
o,o-Dimethyl-o-(3,5,6-trichloro-2-pyridyl)phosphorothioate	NIST Chemistry WebBook
Phosphorothioic acid, O,O-dimethyl O-(3,5,6-trichloro-2-pyridinyl) ester	ChemIDplus
Phosphorothioic acid, O,O-dimethyl O-(3,5,6-trichloro-2-pyridyl) ester	ChemIDplus
Trichlormethylfos	ChemIDplus

Last Modified

04 November 2014

General Comment
2014-10-29	Stravs M, Schymanski E, Singer H, Department of Environmental Chemistry, Eawag