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CAS 1385694-63-2

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Methyl 4-oxo-1-[3-(trifluoromethyl)phenyl]cyclohexanecarboxylate

Description:
Methyl 4-oxo-1-[3-(trifluoromethyl)phenyl]cyclohexanecarboxylate, identified by its CAS number 1385694-63-2, is a chemical compound characterized by its unique molecular structure, which includes a cyclohexane ring substituted with a trifluoromethyl group and a carboxylate ester functional group. This compound typically exhibits properties associated with both aromatic and aliphatic systems, contributing to its potential reactivity and stability. The presence of the trifluoromethyl group enhances lipophilicity and can influence the compound's biological activity, making it of interest in pharmaceutical and agrochemical research. Additionally, the carbonyl and ester functionalities suggest potential for further chemical transformations, such as hydrolysis or reduction. Methyl 4-oxo-1-[3-(trifluoromethyl)phenyl]cyclohexanecarboxylate may also display specific solubility characteristics, depending on the solvent used, and its physical properties, such as boiling point and melting point, would be influenced by its molecular weight and structure. Overall, this compound represents a versatile structure with potential applications in various fields of chemistry.
Formula:C15H15F3O3
InChI:InChI=1S/C15H15F3O3/c1-21-13(20)14(7-5-12(19)6-8-14)10-3-2-4-11(9-10)15(16,17)18/h2-4,9H,5-8H2,1H3
InChI key:InChIKey=SQTVUZSDDOWMDK-UHFFFAOYSA-N
SMILES:C(OC)(=O)C1(CCC(=O)CC1)C2=CC(C(F)(F)F)=CC=C2
Synonyms:
  • Cyclohexanecarboxylic acid, 4-oxo-1-[3-(trifluoromethyl)phenyl]-, methyl ester
  • Methyl 4-oxo-1-[3-(trifluoromethyl)phenyl]cyclohexanecarboxylate
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