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CHEBI:28410 - 2,2-bis(4-chlorophenyl)ethanol

Default Structure
ChEBI IDCHEBI:28410
ChEBI Name2,2-bis(4-chlorophenyl)ethanol
Stars
DefinitionA organochlorine compound that is 4,4'-dichlorodiphenylmethane in which one of the methylene hydrogens is replaced by a hydroxymethyl group.
Secondary ChEBI IDsCHEBI:858, CHEBI:19285
Last Modified23 October 2014
DownloadsMolfile
FormulaC14H12Cl2O
Net Charge0
Average Mass267.155
Monoisotopic Mass266.02652
SMILESOCC(c1ccc(Cl)cc1)c1ccc(Cl)cc1
InChIInChI=1S/C14H12Cl2O/c15-12-5-1-10(2-6-12)14(9-17)11-3-7-13(16)8-4-11/h1-8,14,17H,9H2
InChIKeyZVIDYKRNLNAXFT-UHFFFAOYSA-N
Roles Classification
Biological Role:
xenobiotic metabolite  Any metabolite produced by metabolism of a xenobiotic compound.
ChEBI Ontology
Outgoing Relation(s)
2,2-bis(4-chlorophenyl)ethanol (CHEBI:28410) has functional parent 4,4'-dichlorodiphenylmethane (CHEBI:28763)
2,2-bis(4-chlorophenyl)ethanol (CHEBI:28410) has role xenobiotic metabolite (CHEBI:76206)
2,2-bis(4-chlorophenyl)ethanol (CHEBI:28410) is a monochlorobenzenes (CHEBI:83403)
2,2-bis(4-chlorophenyl)ethanol (CHEBI:28410) is a primary alcohol (CHEBI:15734)
Synonyms  Source
2,2-bis(4-chlorophenyl)ethanolChEBI
2,2-Bis(4'-chlorophenyl)ethanolKEGG COMPOUND
DDOHKEGG COMPOUND
Manual XrefsDatabases
c0500UM-BBD
C06639KEGG COMPOUND
Registry NumbersSources
Reaxys:2055080Reaxys
CAS:2642-82-2KEGG COMPOUND
Citations