CHEBI:64825 - 2,5-dimethylbenzoic acid

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ChEBI Name 2,5-dimethylbenzoic acid
ChEBI ID CHEBI:64825
Definition A dimethylbenzoic acid in which the two methyl groups are located at positions 2 and 5.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C9H10O2
Net Charge 0
Average Mass 150.17450
Monoisotopic Mass 150.06808
InChI InChI=1S/C9H10O2/c1-6-3-4-7(2)8(5-6)9(10)11/h3-5H,1-2H3,(H,10,11)
InChIKey XZRHNAFEYMSXRG-UHFFFAOYSA-N
SMILES Cc1ccc(C)c(c1)C(O)=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-dimethylbenzoic acid (CHEBI:64825) has functional parent benzoic acid (CHEBI:30746)
2,5-dimethylbenzoic acid (CHEBI:64825) is a dimethylbenzoic acid (CHEBI:64810)
2,5-dimethylbenzoic acid (CHEBI:64825) is conjugate acid of 2,5-dimethylbenzoate (CHEBI:64826)
Incoming 2,5-dimethylbenzoate (CHEBI:64826) is conjugate base of 2,5-dimethylbenzoic acid (CHEBI:64825)
IUPAC Name
2,5-dimethylbenzoic acid
Synonyms Sources
2,5-dimethylbenzenecarboxylic acid ChEBI
2-carboxy-1,4-dimethylbenzene NIST Chemistry WebBook
Isoxylic acid NIST Chemistry WebBook
Registry Numbers Types Sources
610-72-0 CAS Registry Number NIST Chemistry WebBook
610-72-0 CAS Registry Number ChemIDplus
971588 Reaxys Registry Number Reaxys
Last Modified
23 July 2012