CHEBI:30793 - 2-chlorobenzoic acid

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 2-chlorobenzoic acid
ChEBI ID CHEBI:30793
Definition A monochlorobenzoic acid having the chloro group at the 2-position.
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:19506, CHEBI:1043
Supplier Information
Save molfile Download Molfile
Formula C7H5ClO2
Net Charge 0
Average Mass 156.56600
Monoisotopic Mass 155.998
InChI InChI=1S/C7H5ClO2/c8-6-4-2-1-3-5(6)7(9)10/h1-4H,(H,9,10)
InChIKey IKCLCGXPQILATA-UHFFFAOYSA-N
SMILES OC(=O)c1ccccc1Cl
Metabolite of Species Details
Brassica napus (NCBI:3708) Found in trunk bark (BTO:0001494). See: PubMed
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): plant hormone
A plant growth regulator that modulates the formation of stems, leaves and flowers, as well as the development and ripening of fruit. The term includes endogenous and non-endogenous compounds (e.g. active compounds produced by bacteria on the leaf surface) as well as semi-synthetic and fully synthetic compounds.
plant metabolite
Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 2-chlorobenzoic acid (CHEBI:30793) has role plant hormone (CHEBI:37848)
2-chlorobenzoic acid (CHEBI:30793) has role plant metabolite (CHEBI:76924)
2-chlorobenzoic acid (CHEBI:30793) is a 2-halobenzoic acid (CHEBI:70862)
2-chlorobenzoic acid (CHEBI:30793) is a monochlorobenzoic acid (CHEBI:51967)
2-chlorobenzoic acid (CHEBI:30793) is conjugate acid of 2-chlorobenzoate (CHEBI:28303)
Incoming 2-chlorobenzoyl chloride (CHEBI:60719) has functional parent 2-chlorobenzoic acid (CHEBI:30793)
2-chlorobenzoate (CHEBI:28303) is conjugate base of 2-chlorobenzoic acid (CHEBI:30793)
2-chlorobenzoyl group (CHEBI:60718) is substituent group from 2-chlorobenzoic acid (CHEBI:30793)
IUPAC Name
2-chlorobenzoic acid
Synonyms Sources
2-Chlorobenzoic acid KEGG COMPOUND
o-Chlorobenzoic acid KEGG COMPOUND
o-chlorobenzoic acid NIST Chemistry WebBook
Database Links Databases
C02357 KEGG COMPOUND
CPD-256 MetaCyc
View more database links
Registry Numbers Types Sources
118-91-2 CAS Registry Number KEGG COMPOUND
118-91-2 CAS Registry Number ChemIDplus
118-91-2 CAS Registry Number NIST Chemistry WebBook
165221 Gmelin Registry Number Gmelin
907340 Beilstein Registry Number Beilstein
907340 Reaxys Registry Number Reaxys
Citations Waiting for Citations Types Sources
18623396 PubMed citation Europe PMC
20149490 PubMed citation Europe PMC
21312330 PubMed citation Europe PMC
2743216 PubMed citation Europe PMC
8846991 PubMed citation Europe PMC
8934785 PubMed citation Europe PMC
Last Modified
01 September 2014