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CAS 437711-25-6

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1-(2-Chlorophenyl)-3-(trifluoromethyl)-1H-pyrazole-5-carboxylic acid

Description:
1-(2-Chlorophenyl)-3-(trifluoromethyl)-1H-pyrazole-5-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 2-chlorophenyl group indicates that a chlorine atom is substituted on the phenyl ring, contributing to the compound's lipophilicity and potential biological activity. The trifluoromethyl group enhances the compound's electronic properties, often increasing its potency and stability in various chemical environments. As a carboxylic acid, it features a carboxyl functional group (-COOH), which can participate in hydrogen bonding and influence solubility in polar solvents. This compound is of interest in medicinal chemistry and agrochemicals due to its potential applications in pharmaceuticals and crop protection agents. Its unique structural features may contribute to specific interactions with biological targets, making it a subject of research in drug development and chemical synthesis. Safety and handling precautions should be observed, as with all chemical substances, due to potential toxicity and environmental impact.
Formula:C11H6ClF3N2O2
InChI:InChI=1S/C11H6ClF3N2O2/c12-6-3-1-2-4-7(6)17-8(10(18)19)5-9(16-17)11(13,14)15/h1-5H,(H,18,19)
InChI key:InChIKey=ZZAQBCQHLAXJBW-UHFFFAOYSA-N
SMILES:C(O)(=O)C=1N(N=C(C(F)(F)F)C1)C2=C(Cl)C=CC=C2
Synonyms:
  • 1-(2-Chlorophenyl)-3-(trifluoromethyl)-1H-pyrazole-5-carboxylic acid
  • 1-(2-Chlorophenyl)-3-trifluoromethyl-1H-pyrazole-5-carboxylic acid
  • 1H-Pyrazole-5-carboxylic acid, 1-(2-chlorophenyl)-3-(trifluoromethyl)-
  • 2-(2-Chloro-phenyl)-5-trifluoromethyl-2H-pyrazole-3-carboxylic acid
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