CAS 98534-86-2

1H-Pyrazole-4-carboxylic acid, 1-(2-pyridinyl)-5-(trifluoromethyl)-

Description:

1H-Pyrazole-4-carboxylic acid, 1-(2-pyridinyl)-5-(trifluoromethyl)-, identified by CAS number 98534-86-2, is a heterocyclic organic compound featuring a pyrazole ring substituted with a carboxylic acid group and a pyridine moiety. This compound exhibits a trifluoromethyl group, which significantly influences its chemical reactivity and physical properties. The presence of the carboxylic acid functional group suggests that it can participate in acid-base reactions, while the trifluoromethyl group can enhance lipophilicity and alter the compound's electronic properties. The pyridine ring contributes to the overall aromatic character and may also participate in coordination with metal ions. This compound is of interest in various fields, including medicinal chemistry and agrochemicals, due to its potential biological activity and ability to serve as a building block for more complex molecules. Its solubility, stability, and reactivity can vary based on environmental conditions, making it a subject of study for applications in drug development and material science.

Formula: C₁₀H₆F₃N₃O₂

InChI: InChI=1S/C10H6F3N3O2/c11-10(12,13)8-6(9(17)18)5-15-16(8)7-3-1-2-4-14-7/h1-5H,(H,17,18)

InChI key: InChIKey=ZQXVRORVHVWEMM-UHFFFAOYSA-N

SMILES: C(F)(F)(F)C=1N(N=CC1C(O)=O)C2=CC=CC=N2

Synonyms:

• 1-(2-Pyridinyl)-5-(trifluoromethyl)-1H-pyrazole-4-carboxylic acid
• 1-(Pyridin-2-yl)-5-(trifluoromethyl)-1H-pyrazole-4-carboxylic acid
• 1H-Pyrazole-4-carboxylic acid, 1-(2-pyridinyl)-5-(trifluoromethyl)-

1-(Pyridin-2-yl)-5-(trifluoromethyl)-1H-pyrazole-4-carboxylic acid

CAS: 98534-86-2

Versatile small molecule scaffold

Formula: C₁₀H₆F₃N₃O₂

Purity: Min. 95%

Molecular weight: 257.17 g/mol

Ref: 3D-YDA53486