CAS 32454-26-5

Methyl α,α,3-trimethylbenzeneacetate

Description:

Methyl α,α,3-trimethylbenzeneacetate, identified by its CAS number 32454-26-5, is an organic compound belonging to the class of esters. It is characterized by its structure, which includes a benzene ring substituted with three methyl groups and an acetate functional group. This compound typically exhibits a pleasant, sweet aroma, making it useful in the fragrance and flavoring industries. Its physical properties may include a relatively low boiling point and moderate solubility in organic solvents, while being less soluble in water due to its hydrophobic nature. Methyl α,α,3-trimethylbenzeneacetate is often synthesized through esterification reactions, where an alcohol reacts with an acid, leading to the formation of the ester bond. Safety data sheets for this compound would indicate standard precautions for handling, as with many organic chemicals, including the need for proper ventilation and protective equipment to avoid inhalation or skin contact. Overall, this compound is of interest in both industrial applications and research contexts due to its unique chemical properties and potential uses.

Formula: C₁₂H₁₆O₂

InChI: InChI=1S/C12H16O2/c1-9-6-5-7-10(8-9)12(2,3)11(13)14-4/h5-8H,1-4H3

InChI key: InChIKey=JDCYNMQZUSSLLY-UHFFFAOYSA-N

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

Synonyms:

• Hydratropic acid, m,α-dimethyl-, methyl ester
• Benzeneacetic acid, α,α,3-trimethyl-, methyl ester
• Methyl 2-methyl-2-(m-tolyl)propanoate
• Methyl α,α,3-trimethylbenzeneacetate