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InChI=1S/CH4O/c1-2/h2H,1H3
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> Main
CHEBI:132357 - 2,3,4,5-tetrachlorophenol
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ChEBI Ontology
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ChEBI Name
2,3,4,5-tetrachlorophenol
ChEBI ID
CHEBI:132357
Definition
A tetrachlorophenol in which the chlorines are located at positions 2, 3, 4, and 5.
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C6H2Cl4O
Net Charge
0
Average Mass
231.891
Monoisotopic Mass
229.88598
InChI
InChI=1S/C6H2Cl4O/c7-2-1-3(11)5(9)6(10)4(2)8/h1,11H
InChIKey
RULKYXXCCZZKDZ-UHFFFAOYSA-N
SMILES
C1(O)=C(C(=C(C(=C1)Cl)Cl)Cl)Cl
Roles Classification
Biological Role
(s):
xenobiotic metabolite
Any metabolite produced by metabolism of a xenobiotic compound.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
2,3,4,5-tetrachlorophenol (
CHEBI:132357
)
has role
xenobiotic metabolite (
CHEBI:76206
)
2,3,4,5-tetrachlorophenol (
CHEBI:132357
)
is a
tetrachlorophenol (
CHEBI:52049
)
IUPAC Name
2,3,4,5-tetrachlorophenol
Synonyms
Sources
1-hydroxy-2,3,4,5-tetrachlorobenzene
ChEBI
2,3,4,5-TeCP
ChEBI
Registry Numbers
Types
Sources
2049590
Reaxys Registry Number
Reaxys
4901-51-3
CAS Registry Number
ChemIDplus
4901-51-3
CAS Registry Number
NIST Chemistry WebBook
Citations
Types
Sources
1260504
PubMed citation
Europe PMC
18970864
PubMed citation
Europe PMC
2219952
PubMed citation
Europe PMC
23123243
PubMed citation
Europe PMC
4046067
PubMed citation
Europe PMC
50558
PubMed citation
Europe PMC
580377
PubMed citation
Europe PMC
6991923
PubMed citation
Europe PMC
7445521
PubMed citation
Europe PMC
Last Modified
04 July 2016