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CHEBI:6842 - methoxychlor

ChEBI IDCHEBI:6842
ChEBI Namemethoxychlor
Stars
Last Modified26 February 2016
DownloadsMolfile
FormulaC16H15Cl3O2
Net Charge0
Average Mass345.653
Monoisotopic Mass344.01376
SMILESCOc1ccc(C(c2ccc(OC)cc2)C(Cl)(Cl)Cl)cc1
InChIInChI=1S/C16H15Cl3O2/c1-20-13-7-3-11(4-8-13)15(16(17,18)19)12-5-9-14(21-2)10-6-12/h3-10,15H,1-2H3
InChIKeyIAKOZHOLGAGEJT-UHFFFAOYSA-N
Roles Classification
Applications:
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.
pesticide  Strictly, a substance intended to kill pests. In common usage, any substance used for controlling, preventing, or destroying animal, microbiological or plant pests.
pesticide  Strictly, a substance intended to kill pests. In common usage, any substance used for controlling, preventing, or destroying animal, microbiological or plant pests.
ChEBI Ontology
Outgoing Relation(s)
methoxychlor (CHEBI:6842) has functional parent 1,1,1-trichloro-2,2-diphenylethane (CHEBI:39161)
methoxychlor (CHEBI:6842) is a organochlorine insecticide (CHEBI:25705)
IUPAC Name 
1,1'-(2,2,2-trichloroethane-1,1-diyl)bis(4-methoxybenzene)
Synonyms  Source
MethoxychlorKEGG COMPOUND
1,1,1-trichloro-2,2-bis(p-methoxyphenyl)ethaneNIST Chemistry WebBook
p,p'-methoxychlorNIST Chemistry WebBook
methoxy-DDTChemIDplus
dimethoxy-DDTChemIDplus
2,2-bis(p-methoxyphenyl)-1,1,1-trichloroethaneChemIDplus
Manual XrefsDatabases
C11043KEGG COMPOUND
LSM-37160LINCS
460PPDB
460VSDB
Registry NumbersSources
Gmelin:513417Gmelin
Beilstein:2057367Beilstein
CAS:72-43-5KEGG COMPOUND
CAS:72-43-5NIST Chemistry WebBook
CAS:72-43-5ChemIDplus