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InChI=1S/CH4O/c1-2/h2H,1H3
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> Main
CHEBI:28979 - 4'-chlorobiphenyl-2,3-diol
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ChEBI Ontology
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ChEBI Name
4'-chlorobiphenyl-2,3-diol
ChEBI ID
CHEBI:28979
Definition
A member of the class of hydroxybiphenyls that is catechol in which the hydrogen at position 3 is replaced by a
p
-chlorophenyl group.
Stars
This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs
CHEBI:19317, CHEBI:883
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Formula
C12H9ClO2
Net Charge
0
Average Mass
220.65136
Monoisotopic Mass
220.02911
InChI
InChI=1S/C12H9ClO2/c13-9-6-4-8(5-7-9)10-2-1-3-11(14)12(10)15/h1-7,14-15H
InChIKey
DVSRTUCUOATCJD-UHFFFAOYSA-N
SMILES
Oc1cccc(-c2ccc(Cl)cc2)c1O
ChEBI Ontology
Outgoing
4'-chlorobiphenyl-2,3-diol (
CHEBI:28979
)
has functional parent
4-chlorobiphenyl (
CHEBI:27757
)
4'-chlorobiphenyl-2,3-diol (
CHEBI:28979
)
has functional parent
biphenyl-2,3-diol (
CHEBI:16205
)
4'-chlorobiphenyl-2,3-diol (
CHEBI:28979
)
is a
catechols (
CHEBI:33566
)
4'-chlorobiphenyl-2,3-diol (
CHEBI:28979
)
is a
diol (
CHEBI:23824
)
4'-chlorobiphenyl-2,3-diol (
CHEBI:28979
)
is a
hydroxybiphenyls (
CHEBI:24681
)
4'-chlorobiphenyl-2,3-diol (
CHEBI:28979
)
is a
monochlorobenzenes (
CHEBI:83403
)
Incoming
(1
S
,2
R
)-3-(4-chlorophenyl)cyclohexa-3,5-diene-1,2-diol (
CHEBI:28974
)
has functional parent
4'-chlorobiphenyl-2,3-diol (
CHEBI:28979
)
IUPAC Name
4'-chloro-[1,1'-biphenyl]-2,3-diol
Synonym
Source
2,3-Dihydroxy-4'-chlorobiphenyl
KEGG COMPOUND
Manual Xrefs
Databases
c0179
UM-BBD
C06586
KEGG COMPOUND
View more database links
Registry Numbers
Types
Sources
119386-13-9
CAS Registry Number
UM-BBD
8410406
Beilstein Registry Number
Beilstein
Last Modified
23 October 2014