CHEBI:132298 - 2,5-dichlorobenzoic acid

Main

ChEBI Ontology

Automatic Xrefs

Reactions

Pathways

Models

ChEBI Name 2,5-dichlorobenzoic acid ChEBI ID CHEBI:132298 Definition A chlorobenzoic acid that is benzoic acid in which the ring hydrogens at positions 2 and 5 are substituted by chloro groups. Stars This entity has been manually annotated by the ChEBI Team. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C7H4Cl2O2 Net Charge 0 Average Mass 191.012 Monoisotopic Mass 189.95883 InChI InChI=1S/C7H4Cl2O2/c8-4-1-2-6(9)5(3-4)7(10)11/h1-3H,(H,10,11) InChIKey QVTQYSFCFOGITD-UHFFFAOYSA-N SMILES C(=O)(C1=C(C=CC(=C1)Cl)Cl)O Roles Classification Chemical Role(s): Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Bronsted base). (via oxoacid ) View more via ChEBI Ontology ChEBI Ontology Outgoing 2,5-dichlorobenzoic acid (CHEBI:132298) is a chlorobenzoic acid (CHEBI:23134) 2,5-dichlorobenzoic acid (CHEBI:132298) is a dichlorobenzene (CHEBI:23697) Incoming methyl 2,5-dichlorobenzoate (CHEBI:132299) has functional parent 2,5-dichlorobenzoic acid (CHEBI:132298) IUPAC Name 2,5-dichlorobenzoic acid Registry Numbers Types Sources 50-79-3 CAS Registry Number NIST Chemistry WebBook 50-79-3 CAS Registry Number ChemIDplus Citations Types Sources 16655077 PubMed citation Europe PMC 22169245 PubMed citation Europe PMC 23589238 PubMed citation Europe PMC 7765890 PubMed citation Europe PMC 8262446 PubMed citation Europe PMC 8262447 PubMed citation Europe PMC 8934785 PubMed citation Europe PMC Last Modified 27 June 2016