CHEBI:39096 - α-hexachlorocyclohexane

ChEBI IDCHEBI:39096
ChEBI Nameα-hexachlorocyclohexane
Stars
ASCII Namealpha-hexachlorocyclohexane
Last Modified3 August 2014
SubmitterKirill Degtyarenko
DownloadsMolfile
FormulaC6H6Cl6
Net Charge0
Average Mass290.832
Monoisotopic Mass287.86007
SMILESCl[C@H]1[C@H](Cl)[C@@H](Cl)[C@H](Cl)[C@H](Cl)[C@H]1Cl
InChIInChI=1S/C6H6Cl6/c7-1-2(8)4(10)6(12)5(11)3(1)9/h1-6H/t1-,2-,3-,4-,5+,6+/m1/s1
InChIKeyJLYXXMFPNIAWKQ-SHFUYGGZSA-N
Roles Classification
Chemical Role:
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.
ChEBI Ontology
Outgoing Relation(s)
α-hexachlorocyclohexane (CHEBI:39096) has role persistent organic pollutant (CHEBI:77853)
α-hexachlorocyclohexane (CHEBI:39096) is a hexachlorocyclohexane (CHEBI:24536)
IUPAC Name 
(1R,2R,3R,4R,5S,6S)-1,2,3,4,5,6-hexachlorocyclohexane
Synonyms  Source
α-hexachlorocyclohexaneNIST Chemistry WebBook
α-lindaneNIST Chemistry WebBook
(1α,2α,3β,4β,5α,6β)-1,2,3,4,5,6-hexachlorocyclohexaneChEBI
α-hexachloraneNIST Chemistry WebBook
α-HCHNIST Chemistry WebBook
α-benzene hexachlorideNIST Chemistry WebBook
Manual XrefsDatabases
C15214KEGG COMPOUND
Registry NumbersSources
Beilstein:1907336Beilstein
Gmelin:794031Gmelin
CAS:319-84-6NIST Chemistry WebBook
CAS:319-84-6ChemIDplus
CAS:319-84-6KEGG COMPOUND