CAS 1186195-26-5

Ethyl 4-methoxy-2-(trifluoromethoxy)benzoate

Description:

Ethyl 4-methoxy-2-(trifluoromethoxy)benzoate, identified by its CAS number 1186195-26-5, is an organic compound characterized by its ester functional group, which is derived from benzoic acid. This compound features a methoxy group and a trifluoromethoxy group attached to the benzene ring, contributing to its unique chemical properties. The presence of the trifluoromethoxy group enhances its lipophilicity and may influence its reactivity and interactions in various chemical environments. Ethyl 4-methoxy-2-(trifluoromethoxy)benzoate is typically a colorless to pale yellow liquid with a pleasant odor, and it is soluble in organic solvents. Its molecular structure suggests potential applications in pharmaceuticals, agrochemicals, or as an intermediate in organic synthesis. The trifluoromethyl group is known for imparting biological activity, making this compound of interest in medicinal chemistry. As with many fluorinated compounds, it may exhibit unique properties such as increased stability and altered metabolic pathways, which can be advantageous in drug design and development.

Formula: C₁₁H₁₁F₃O₄

InChI: InChI=1S/C11H11F3O4/c1-3-17-10(15)8-5-4-7(16-2)6-9(8)18-11(12,13)14/h4-6H,3H2,1-2H3

InChI key: InChIKey=AEXVAYHXBHMUGB-UHFFFAOYSA-N

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

Synonyms:

• Ethyl 4-methoxy-2-(trifluoromethoxy)benzoate
• Benzoic acid, 4-methoxy-2-(trifluoromethoxy)-, ethyl ester