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CAS 752222-88-1

:

1-[[3-(Trifluoromethyl)phenyl]methyl]-1H-pyrazole-4-carboxylic acid

Description:
1-[[3-(Trifluoromethyl)phenyl]methyl]-1H-pyrazole-4-carboxylic acid is a chemical compound characterized by its pyrazole core, which is a five-membered ring containing two nitrogen atoms. The presence of a trifluoromethyl group on the phenyl ring significantly enhances its lipophilicity and may influence its biological activity. This compound features a carboxylic acid functional group, which contributes to its acidity and potential reactivity in various chemical reactions. The molecular structure suggests that it may exhibit interesting pharmacological properties, making it a candidate for research in medicinal chemistry. Its CAS number, 752222-88-1, allows for easy identification in chemical databases. The compound's unique combination of functional groups may also lead to specific interactions with biological targets, warranting further investigation into its potential applications in drug development or agrochemicals. Overall, this compound exemplifies the complexity and diversity of organic molecules used in various scientific fields.
Formula:C12H9F3N2O2
InChI:InChI=1S/C12H9F3N2O2/c13-12(14,15)10-3-1-2-8(4-10)6-17-7-9(5-16-17)11(18)19/h1-5,7H,6H2,(H,18,19)
InChI key:InChIKey=UBZZBQIXYQZVDV-UHFFFAOYSA-N
SMILES:C(N1C=C(C(O)=O)C=N1)C2=CC(C(F)(F)F)=CC=C2
Synonyms:
  • 1H-Pyrazole-4-carboxylic acid, 1-[[3-(trifluoromethyl)phenyl]methyl]-
  • 1-[[3-(Trifluoromethyl)phenyl]methyl]-1H-pyrazole-4-carboxylic acid
  • 1-(3-(Trifluoromethyl)benzyl)-1H-pyrazole-4-carboxylic acid
  • 1-(3-Trifluoromethylbenzyl)-1H-pyrazole-4-carboxylic acid
  • 1-(3-(Trifluoromethyl)benzyl)-1H-pyrazole-4-carboxylicacid
  • -1H-pyrazole-4-carboxylic acid
  • 1-[[3-(trifluoromethyl)phenyl]methyl]pyrazole-4-carboxylic acid
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