CAS 898768-61-1

ethyl 3-[3-(p-tolyl)propanoyl]benzoate

Description:

Ethyl 3-[3-(p-tolyl)propanoyl]benzoate, identified by its CAS number 898768-61-1, is an organic compound that belongs to the class of esters. It features a benzoate moiety, which is a benzene ring substituted with an ethyl ester group and a propanoyl group attached to a p-tolyl (para-methylphenyl) substituent. This compound is characterized by its relatively complex structure, which includes aromatic and aliphatic components, contributing to its potential applications in organic synthesis and as an intermediate in the production of pharmaceuticals or agrochemicals. Ethyl 3-[3-(p-tolyl)propanoyl]benzoate may exhibit specific physical properties such as solubility in organic solvents and a distinct melting or boiling point, typical of esters. Its reactivity can be influenced by the presence of functional groups, making it a candidate for various chemical reactions, including esterification and acylation. Safety and handling considerations should be taken into account, as with all chemical substances, to ensure proper laboratory practices.

Formula: C₁₉H₂₀O₃

InChI: InChI=1/C19H20O3/c1-3-22-19(21)17-6-4-5-16(13-17)18(20)12-11-15-9-7-14(2)8-10-15/h4-10,13H,3,11-12H2,1-2H3

SMILES: CCOC(=O)c1cccc(c1)C(=O)CCc1ccc(C)cc1

Synonyms:

• 3'-CARBOETHOXY-3-(4-METHYLPHENYL)PROPIOPHENONE
• Benzoic acid, 3-[3-(4-methylphenyl)-1-oxopropyl]-, ethyl ester