CAS 1350760-71-2

Benzoic acid, 3,5-dicyclopropyl-4-(trifluoromethoxy)-, methyl ester

Description:

Benzoic acid, 3,5-dicyclopropyl-4-(trifluoromethoxy)-, methyl ester, identified by CAS number 1350760-71-2, is an organic compound characterized by its benzoic acid structure modified with specific substituents. The presence of two cyclopropyl groups at the 3 and 5 positions of the benzene ring contributes to its unique steric and electronic properties, potentially influencing its reactivity and solubility. The trifluoromethoxy group at the para position enhances its lipophilicity and may impart distinctive chemical behavior, particularly in terms of interactions with biological systems or other chemical entities. As a methyl ester, it features an ester functional group, which can affect its stability and reactivity in various chemical reactions, including hydrolysis and transesterification. This compound may exhibit interesting pharmacological properties, making it of interest in medicinal chemistry and drug development. Its specific characteristics, such as melting point, boiling point, and solubility, would require empirical data for precise evaluation.

Formula: C₁₅H₁₅F₃O₃

InChI: InChI=1S/C15H15F3O3/c1-20-14(19)10-6-11(8-2-3-8)13(21-15(16,17)18)12(7-10)9-4-5-9/h6-9H,2-5H2,1H3

InChI key: InChIKey=DYOGANMRLZEHHY-UHFFFAOYSA-N

SMILES: O(C(F)(F)F)C1=C(C=C(C(OC)=O)C=C1C2CC2)C3CC3

Synonyms:

• Methyl 3,5-dicyclopropyl-4-(trifluoromethoxy)benzoate
• Benzoic acid, 3,5-dicyclopropyl-4-(trifluoromethoxy)-, methyl ester