CAS 951888-25-8

Ethyl 2,3-dimethyl-α-oxobenzeneacetate

Description:

Ethyl 2,3-dimethyl-α-oxobenzeneacetate, identified by its CAS number 951888-25-8, is an organic compound that belongs to the class of esters. It features a benzene ring substituted with two methyl groups at the 2 and 3 positions, along with an α-oxobenzeneacetate moiety. This compound is characterized by its ester functional group, which typically imparts properties such as volatility and solubility in organic solvents. The presence of the oxo group contributes to its reactivity, making it a potential intermediate in various organic synthesis processes. Ethyl 2,3-dimethyl-α-oxobenzeneacetate may exhibit interesting biological activities, although specific studies on its pharmacological properties may be limited. Its structural features suggest potential applications in the synthesis of more complex organic molecules, including pharmaceuticals and agrochemicals. As with many organic compounds, safety data should be consulted to understand its handling and potential hazards in laboratory or industrial settings.

Formula: C₁₂H₁₄O₃

InChI: InChI=1S/C12H14O3/c1-4-15-12(14)11(13)10-7-5-6-8(2)9(10)3/h5-7H,4H2,1-3H3

InChI key: InChIKey=IQUBZBOEQKFGSX-UHFFFAOYSA-N

SMILES: C(C(OCC)=O)(=O)C1=C(C)C(C)=CC=C1

Synonyms:

• Benzeneacetic acid, 2,3-dimethyl-α-oxo-, ethyl ester
• Ethyl 2,3-dimethyl-α-oxobenzeneacetate
• ethyl 2-(2,3-dimethylphenyl)-2-oxoacetate
• ethyl (2,3-dimethylphenyl)-2-oxoacetate
• Ethyl 2,3-dimethylbenzoylformate