CHEBI:79750 - 4-hydroxy-2',3,5,5'-tetrachlorobiphenyl

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 4-hydroxy-2',3,5,5'-tetrachlorobiphenyl
ChEBI ID CHEBI:79750
Definition A member of the class of hydroxybiphenyls that is biphenyl-4-ol substituted by chloro groups at positions 2', 3, 5 and 5' respectively.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C12H6Cl4O
Net Charge 0
Average Mass 307.98700
Monoisotopic Mass 305.91728
InChI InChI=1S/C12H6Cl4O/c13-7-1-2-9(14)8(5-7)6-3-10(15)12(17)11(16)4-6/h1-5,17H
InChIKey XKKCINSXSUTMIS-UHFFFAOYSA-N
SMILES Oc1c(Cl)cc(cc1Cl)-c1cc(Cl)ccc1Cl
ChEBI Ontology
Outgoing 4-hydroxy-2',3,5,5'-tetrachlorobiphenyl (CHEBI:79750) is a dichlorobenzene (CHEBI:23697)
4-hydroxy-2',3,5,5'-tetrachlorobiphenyl (CHEBI:79750) is a hydroxybiphenyls (CHEBI:24681)
IUPAC Name
2',3,5,5'-tetrachlorobiphenyl-4-ol
Synonym Source
2',3,5,5'-Tetrachloro-4-biphenylol KEGG COMPOUND
Manual Xref Database
C15248 KEGG COMPOUND
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Registry Numbers Types Sources
245084-57-5 CAS Registry Number ChemIDplus
8325434 Reaxys Registry Number Reaxys
Last Modified
02 March 2015