CAS 898787-76-3

ethyl 4-[3-(4-chlorophenyl)propanoyl]benzoate

Description:

Ethyl 4-[3-(4-chlorophenyl)propanoyl]benzoate, identified by its CAS number 898787-76-3, is an organic compound that belongs to the class of esters. It features a benzoate moiety, which is characterized by a benzene ring attached to a carboxylate group, and an ethyl group that contributes to its ester functionality. The presence of a 4-chlorophenyl group indicates that there is a chlorine substituent on the phenyl ring, which can influence the compound's reactivity and physical properties. This compound is likely to exhibit moderate lipophilicity due to its aromatic and aliphatic components, which may affect its solubility in organic solvents. Ethyl 4-[3-(4-chlorophenyl)propanoyl]benzoate may have applications in pharmaceuticals or as an intermediate in organic synthesis, although specific uses would depend on its biological activity and reactivity. Its structural characteristics suggest potential interactions with biological systems, making it a candidate for further investigation in medicinal chemistry.

Formula: C₁₈H₁₇ClO₃

InChI: InChI=1/C18H17ClO3/c1-2-22-18(21)15-8-6-14(7-9-15)17(20)12-5-13-3-10-16(19)11-4-13/h3-4,6-11H,2,5,12H2,1H3

SMILES: CCOC(=O)c1ccc(cc1)C(=O)CCc1ccc(cc1)Cl