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CAS 2006278-06-2

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Ethyl 3-[hydroxy[4-(trifluoromethyl)phenyl]methyl]-4-isoxazolecarboxylate

Description:
Ethyl 3-[hydroxy[4-(trifluoromethyl)phenyl]methyl]-4-isoxazolecarboxylate is a chemical compound characterized by its unique isoxazole ring structure, which contributes to its biological activity. The presence of a trifluoromethyl group enhances its lipophilicity and may influence its interaction with biological targets. The hydroxy group attached to the phenyl ring suggests potential for hydrogen bonding, which can affect solubility and reactivity. This compound is likely to exhibit properties typical of isoxazole derivatives, such as potential anti-inflammatory or analgesic effects, making it of interest in pharmaceutical research. Its ethyl ester functionality may also play a role in its pharmacokinetics, influencing absorption and metabolism. Overall, the combination of these structural features suggests that this compound could have significant applications in medicinal chemistry, particularly in the development of new therapeutic agents. However, specific biological activities and safety profiles would require further investigation through experimental studies.
Formula:C14H12F3NO4
InChI:InChI=1S/C14H12F3NO4/c1-2-21-13(20)10-7-22-18-11(10)12(19)8-3-5-9(6-4-8)14(15,16)17/h3-7,12,19H,2H2,1H3
InChI key:InChIKey=DKWQKQCZNNPVIL-UHFFFAOYSA-N
SMILES:C(O)(C=1C(C(OCC)=O)=CON1)C2=CC=C(C(F)(F)F)C=C2
Synonyms:
  • 4-Isoxazolecarboxylic acid, 3-[hydroxy[4-(trifluoromethyl)phenyl]methyl]-, ethyl ester
  • Ethyl 3-[hydroxy[4-(trifluoromethyl)phenyl]methyl]-4-isoxazolecarboxylate
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