2,4,6-trichlorophenol (CHEBI:28755)

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ChEBI Name	2,4,6-trichlorophenol

ChEBI ID	CHEBI:28755

Definition	A trichlorophenol with phenolic substituents on positions 2, 4 and 6.

Stars	This entity has been manually annotated by the ChEBI Team.

Secondary ChEBI IDs	CHEBI:898, CHEBI:19334

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Formulae

C6H3Cl3O
C6H3Cl3O

Net Charge

Average Mass

197.44600

Monoisotopic Mass

195.92495

InChI

InChI=1S/C6H3Cl3O/c7-3-1-4(8)6(10)5(9)2-3/h1-2,10H

InChIKey

LINPIYWFGCPVIE-UHFFFAOYSA-N

SMILES

Oc1c(Cl)cc(Cl)cc1Cl

Roles Classification
Biological Role(s):	carcinogenic agent A role played by a chemical compound which is known to induce a process of carcinogenesis by corrupting normal cellular pathways, leading to the acquistion of tumoral capabilities.

ChEBI Ontology
Outgoing	2,4,6-trichlorophenol (CHEBI:28755) has role carcinogenic agent (CHEBI:50903) 2,4,6-trichlorophenol (CHEBI:28755) is a trichlorophenol (CHEBI:27102) 2,4,6-trichlorophenol (CHEBI:28755) is conjugate acid of 2,4,6-trichlorophenolate (CHEBI:140426)

Incoming	2,4,6-trichlorophenolate (CHEBI:140426) is conjugate base of 2,4,6-trichlorophenol (CHEBI:28755)

IUPAC Name

2,4,6-trichlorophenol

Last Modified

15 March 2018

General Comment
2014-01-30	Found in urine samples of humans exposed to organochlorine compounds.