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CHEBI:81525 - 2,3,3',4,4',5,5'-Heptachlorobiphenyl

ChEBI IDCHEBI:81525
ChEBI Name2,3,3',4,4',5,5'-Heptachlorobiphenyl
Stars
Last Modified18 May 2015
DownloadsMolfile
FormulaC12H3Cl7
Net Charge0
Average Mass395.327
Monoisotopic Mass391.80544
SMILESClc1cc(-c2cc(Cl)c(Cl)c(Cl)c2Cl)cc(Cl)c1Cl
InChIInChI=1S/C12H3Cl7/c13-6-1-4(2-7(14)10(6)17)5-3-8(15)11(18)12(19)9(5)16/h1-3H
InChIKeyXUAWBXBYHDRROL-UHFFFAOYSA-N
Roles Classification
Chemical Roles:
persistent organic pollutant  Any environmental contaminant that is resistant to environmental degradation through photolytic, biological or chemical processes. Such substances can have significant impact on health and the environment, as they persist in the environment, bioaccumulate in animal tissue and so biomagnify in food chains.
persistent organic pollutant  Any environmental contaminant that is resistant to environmental degradation through photolytic, biological or chemical processes. Such substances can have significant impact on health and the environment, as they persist in the environment, bioaccumulate in animal tissue and so biomagnify in food chains.
persistent organic pollutant  Any environmental contaminant that is resistant to environmental degradation through photolytic, biological or chemical processes. Such substances can have significant impact on health and the environment, as they persist in the environment, bioaccumulate in animal tissue and so biomagnify in food chains.
Application:
endocrine disruptor  Any compound that can disrupt the functions of the endocrine (hormone) system
ChEBI Ontology
Outgoing Relation(s)
2,3,3',4,4',5,5'-Heptachlorobiphenyl (CHEBI:81525) is a heptachlorobiphenyl (CHEBI:85782)
2,3,3',4,4',5,5'-Heptachlorobiphenyl (CHEBI:81525) is a tetrachlorobenzene (CHEBI:26888)
2,3,3',4,4',5,5'-Heptachlorobiphenyl (CHEBI:81525) is a trichlorobenzene (CHEBI:27096)
Synonym  Source
PCB 189KEGG COMPOUND
Manual XrefsDatabases
C18123KEGG COMPOUND
Registry NumbersSources
CAS:39635-31-9KEGG COMPOUND