CAS 98534-81-7: 1-Phenyl-5-(trifluoromethyl)-1H-pyrazole-4-carboxylic acid
Formula:C11H7F3N2O2
InChI:InChI=1S/C11H7F3N2O2/c12-11(13,14)9-8(10(17)18)6-15-16(9)7-4-2-1-3-5-7/h1-6H,(H,17,18)
InChI key:InChIKey=SMPJBTIFNUUWGQ-UHFFFAOYSA-N
SMILES:C(F)(F)(F)C=1N(N=CC1C(O)=O)C2=CC=CC=C2
Synonyms:- 1-Phenyl-5-trifluoromethylpyrazole-4-carboxylic acid
- 1H-Pyrazole-4-carboxylic acid, 1-phenyl-5-(trifluoromethyl)-
- 1-Phenyl-5-trifluoromethyl-1H-pyrazole-4-carboxylic acid
- 1-Phenyl-5-(trifluoromethyl)-1H-pyrazole-4-carboxylic acid
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Found 4 products.
1-Phenyl-5-(trifluoromethyl)pyrazole-4-carboxylic acid
CAS:Purity:95.0%Color and Shape:SolidMolecular weight:256.18399047851561-Phenyl-5-(trifluoromethyl)-1H-pyrazole-4-carboxylic acid
CAS:Formula:C11H7F3N2O2Purity:97%Color and Shape:SolidMolecular weight:256.18071-Phenyl-5-(trifluoromethyl)pyrazole-4-carboxylic acid
CAS:1-Phenyl-5-(trifluoromethyl)pyrazole-4-carboxylic acidPurity:95Color and Shape:Off-White SolidMolecular weight:256.18g/mol1-Phenyl-5-(trifluoromethyl)pyrazole-4-carboxylic acid
CAS:1-Phenyl-5-(trifluoromethyl)pyrazole-4-carboxylic acid is a white crystalline solid with a melting point of about 120°C. It is soluble in water, methanol and ethanol. 1-Phenyl-5-(trifluoromethyl)pyrazole-4-carboxylic acid has been used as an intermediate for the synthesis of fluoroquinolones. This compound can be used to synthesize fluoroquinolones by reacting it with a carboxylic acid to form an ester. The crystal structure analysis and diffraction of 1-phenyl 5-(trifluoromethyl)pyrazole 4-carboxylic acid show that this compound has eight hydrogen bonds and two acceptors. The molecule also has a molecular electrostatic potential of -0.6 eV, which indicates that the electron density is concentrated near the fluorFormula:C11H7F3N2O2Purity:Min. 95%Molecular weight:256.18 g/mol
