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CAS 1385694-46-1

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Methyl 4-oxo-1-(2,4,5-trifluorophenyl)cyclohexanecarboxylate

Description:
Methyl 4-oxo-1-(2,4,5-trifluorophenyl)cyclohexanecarboxylate, identified by its CAS number 1385694-46-1, is a chemical compound characterized by its unique structure that includes a cyclohexane ring, a ketone functional group, and a trifluorophenyl substituent. This compound typically exhibits properties associated with both ester and ketone functionalities, which may influence its reactivity and solubility in various solvents. The presence of trifluoromethyl groups often enhances lipophilicity and can impart specific biological activities, making such compounds of interest in medicinal chemistry and agrochemical applications. Additionally, the compound's molecular structure suggests potential for various chemical transformations, including nucleophilic substitutions and reductions. Its stability and reactivity can be influenced by the steric and electronic effects of the trifluorophenyl group. Overall, Methyl 4-oxo-1-(2,4,5-trifluorophenyl)cyclohexanecarboxylate represents a class of compounds that may have significant applications in synthetic organic chemistry and pharmacology.
Formula:C14H13F3O3
InChI:InChI=1S/C14H13F3O3/c1-20-13(19)14(4-2-8(18)3-5-14)9-6-11(16)12(17)7-10(9)15/h6-7H,2-5H2,1H3
InChI key:InChIKey=XDRAMOQVRYZSIV-UHFFFAOYSA-N
SMILES:C(OC)(=O)C1(CCC(=O)CC1)C2=C(F)C=C(F)C(F)=C2
Synonyms:
  • Methyl 4-oxo-1-(2,4,5-trifluorophenyl)cyclohexanecarboxylate
  • Cyclohexanecarboxylic acid, 4-oxo-1-(2,4,5-trifluorophenyl)-, methyl ester
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