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CHEBI:83523 - pethoxamide

ChEBI IDCHEBI:83523
ChEBI Namepethoxamide
Stars
DefinitionA monocarboxylic acid amide that is acetamide substituted by a chloro group at position 2 and a 2-ethoxyethyl and a 2-methyl-1-phenylprop-1-en-1-yl at the nitrogen atom. It is an agrochemical used as a herbicide.
Last Modified18 November 2014
DownloadsMolfile
FormulaC16H22ClNO2
Net Charge0
Average Mass295.810
Monoisotopic Mass295.13391
SMILESCCOCCN(C(=O)CCl)C(=C(C)C)c1ccccc1
InChIInChI=1S/C16H22ClNO2/c1-4-20-11-10-18(15(19)12-17)16(13(2)3)14-8-6-5-7-9-14/h5-9H,4,10-12H2,1-3H3
InChIKeyCSWIKHNSBZVWNQ-UHFFFAOYSA-N
Roles Classification
Chemical Role:
environmental contaminant  Any minor or unwanted substance introduced into the environment that can have undesired effects.
Biological Role:
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.
Applications:
agrochemical  An agrochemical is a substance that is used in agriculture or horticulture.
herbicide  A substance used to destroy plant pests.
ChEBI Ontology
Outgoing Relation(s)
pethoxamide (CHEBI:83523) has role agrochemical (CHEBI:33286)
pethoxamide (CHEBI:83523) has role environmental contaminant (CHEBI:78298)
pethoxamide (CHEBI:83523) has role herbicide (CHEBI:24527)
pethoxamide (CHEBI:83523) has role xenobiotic (CHEBI:35703)
pethoxamide (CHEBI:83523) is a ether (CHEBI:25698)
pethoxamide (CHEBI:83523) is a monocarboxylic acid amide (CHEBI:29347)
pethoxamide (CHEBI:83523) is a olefinic compound (CHEBI:78840)
pethoxamide (CHEBI:83523) is a organochlorine compound (CHEBI:36683)
IUPAC Name 
2-chloro-N-(2-ethoxyethyl)-N-(2-methyl-1-phenylprop-1-en-1-yl)acetamide
Synonym  Source
pethoxamidChemIDplus
Manual XrefsDatabases
pethoxamidAlan Wood's Pesticides
WO0217719Patent
EP1315420Patent
1011PPDB
Registry NumbersSources
Reaxys:4873772Reaxys
CAS:106700-29-2ChemIDplus