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CHEBI:142786 - 2'-hydroxytriclocarban
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ChEBI Name
2'-hydroxytriclocarban
ChEBI ID
CHEBI:142786
Definition
A phenylurea that is urea substituted by 4-chloro-2-hydroxyphenyl and 3,4-dichlorophenyl groups at positions 1 and 3 respectively. A metabolite of triclocarban.
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This entity has been manually annotated by the ChEBI Team.
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Formula
C13H9Cl3N2O2
Net Charge
0
Average Mass
331.582
Monoisotopic Mass
329.97296
InChI
InChI=1S/C13H9Cl3N2O2/c14-7-1-4-11(12(19)5-7)18-13(20)17-8-2-3-9(15)10(16)6-8/h1-6,19H,(H2,17,18,20)
InChIKey
OKSXGOLSKDABPC-UHFFFAOYSA-N
SMILES
C(NC1=C(C=C(C=C1)Cl)O)(NC2=CC=C(C(=C2)Cl)Cl)=O
ChEBI Ontology
Outgoing
2'-hydroxytriclocarban (
CHEBI:142786
)
is a
dichlorobenzene (
CHEBI:23697
)
2'-hydroxytriclocarban (
CHEBI:142786
)
is a
monochlorobenzenes (
CHEBI:83403
)
2'-hydroxytriclocarban (
CHEBI:142786
)
is a
phenylureas (
CHEBI:134043
)
IUPAC Name
1-(4-chloro-2-hydroxyphenyl)-3-(3,4-dichlorophenyl)urea
Synonyms
Sources
2'-OH TCC
ChEBI
N
-(4-chloro-2-hydroxyphenyl)-
N
'-(3,4-dichlorophenyl)urea
ChEBI
Registry Number
Type
Source
63348-26-5
CAS Registry Number
ChemIDplus
Citation
Type
Source
30033524
PubMed citation
Europe PMC
Last Modified
30 September 2020