Terminology Service for NFDI4Health
2,5-dimethylbenzoate
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http://purl.obolibrary.org/obo/CHEBI_64826
A dimethylbenzoate in which the two methyl groups are located at positions 2 and 5.
Term info
Label
2,5-dimethylbenzoate
Synonyms
- 2,5-dimethylbenzoate
Subsets
3_STAR
charge
-1
formula
C9H9O2
has obo namespace
chebi_ontology
has related synonym
2,5-dimethylbenzoate anion
id
CHEBI:64826
inchi
InChI=1S/C9H10O2/c1-6-3-4-7(2)8(5-6)9(10)11/h3-5H,1-2H3,(H,10,11)/p-1
inchikey
XZRHNAFEYMSXRG-UHFFFAOYSA-M
mass
149.16660
monoisotopicmass
149.06080
smiles
Cc1ccc(C)c(c1)C([O-])=O
Term relations
Subclass of:
- dimethylbenzoate
- is conjugate base of some 2,5-dimethylbenzoic acid
- has functional parent some benzoate
Related from: