2,3,5-trichlorobenzoic acid (CHEBI:166848)

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ChEBI Name	2,3,5-trichlorobenzoic acid

ChEBI ID	CHEBI:166848

Definition	A chlorobenzoic acid that is benzoic acid in which the ring hydrogens at positions 2,3 and 5 are substituted by chloro groups.

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

Submitter	Elad Noor

Supplier Information

Download	Molfile XML SDF

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Formula

C7H3Cl3O2

Net Charge

Average Mass

225.450

Monoisotopic Mass

223.91986

InChI

InChI=1S/C7H3Cl3O2/c8-3-1-4(7(11)12)6(10)5(9)2-3/h1-2H,(H,11,12)

InChIKey

CGFDSIZRJWMQPP-UHFFFAOYSA-N

SMILES

OC(=O)C1=C(Cl)C(Cl)=CC(Cl)=C1

Roles Classification
Chemical Role(s):	Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Bronsted base). (via oxoacid )

Biological Role(s):	bacterial xenobiotic metabolite Any bacterial metabolite produced by metabolism of a xenobiotic compound in bacteria.

ChEBI Ontology
Outgoing	2,3,5-trichlorobenzoic acid (CHEBI:166848) has role bacterial xenobiotic metabolite (CHEBI:76976) 2,3,5-trichlorobenzoic acid (CHEBI:166848) is a chlorobenzoic acid (CHEBI:23134) 2,3,5-trichlorobenzoic acid (CHEBI:166848) is a trichlorobenzene (CHEBI:27096) 2,3,5-trichlorobenzoic acid (CHEBI:166848) is conjugate acid of 2,3,5-trichlorobenzoate (CHEBI:166859)

Incoming	2,3,5-trichlorobenzoate (CHEBI:166859) is conjugate base of 2,3,5-trichlorobenzoic acid (CHEBI:166848)

IUPAC Name

2,3,5-trichlorobenzoic acid

Synonym	Source
benzoic acid, 2,3,5-trichloro-	ChemIDplus

Last Modified

13 November 2020