CHEBI:59472 - 4-amino-2-chlorobenzoic acid

Main

ChEBI Ontology

Automatic Xrefs

Reactions

Pathways

Models

ChEBI Name 4-amino-2-chlorobenzoic acid ChEBI ID CHEBI:59472 Definition 4-Aminobenzoic acid in which one of the hydrogens ortho- to the carboxylic acid group is substituted by chlorine. 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 C7H6ClNO2 Net Charge 0 Average Mass 171.58100 Monoisotopic Mass 171.00871 InChI InChI=1S/C7H6ClNO2/c8-6-3-4(9)1-2-5(6)7(10)11/h1-3H,9H2,(H,10,11) InChIKey MBDUKNCPOPMRJQ-UHFFFAOYSA-N SMILES Nc1ccc(C(O)=O)c(Cl)c1 Roles Classification Chemical Role(s): Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Bronsted base). (via oxoacid ) Bronsted base A molecular entity capable of accepting a hydron from a donor (Bronsted acid). (via organic amino compound ) View more via ChEBI Ontology ChEBI Ontology Outgoing 4-amino-2-chlorobenzoic acid (CHEBI:59472) is a aminobenzoic acid (CHEBI:22495) 4-amino-2-chlorobenzoic acid (CHEBI:59472) is a monochlorobenzenes (CHEBI:83403) Incoming chloroprocaine (CHEBI:3636) has functional parent 4-amino-2-chlorobenzoic acid (CHEBI:59472) Synonyms Sources 2-chloro-4-aminobenzoic acid ChemIDplus 2-chloro-p-aminobenzoic acid ChemIDplus o-chloro-p-aminobenzoic acid ChemIDplus Registry Numbers Types Sources 2457-76-3 CAS Registry Number NIST Chemistry WebBook 2457-76-3 CAS Registry Number ChemIDplus 2803668 Beilstein Registry Number Beilstein Last Modified 23 October 2014