CAS 910037-17-1

2-[1-Methyl-3-(trifluoromethyl)-1H-pyrazol-5-yl]benzonitrile

Description:

2-[1-Methyl-3-(trifluoromethyl)-1H-pyrazol-5-yl]benzonitrile, with the CAS number 910037-17-1, is a chemical compound characterized by its complex structure, which includes a pyrazole ring and a benzonitrile moiety. This compound typically exhibits properties such as being a solid at room temperature, with potential applications in pharmaceuticals or agrochemicals due to its unique functional groups. The presence of the trifluoromethyl group enhances its lipophilicity and may influence its biological activity. The nitrile group contributes to its reactivity and can participate in various chemical reactions, making it a versatile intermediate in organic synthesis. Additionally, the compound may exhibit specific spectral characteristics in techniques such as NMR and IR spectroscopy, which can be used for its identification and characterization. Overall, this compound's unique structural features and functional groups suggest potential utility in various chemical applications, although specific properties such as solubility, melting point, and reactivity would need to be determined experimentally.

Formula: C₁₂H₈F₃N₃

InChI: InChI=1S/C12H8F3N3/c1-18-10(6-11(17-18)12(13,14)15)9-5-3-2-4-8(9)7-16/h2-6H,1H3

InChI key: InChIKey=RHTYRUPBJDKBMM-UHFFFAOYSA-N

SMILES: CN1C(=CC(C(F)(F)F)=N1)C2=C(C#N)C=CC=C2

Synonyms:

• 2-[1-Methyl-3-(trifluoromethyl)-1H-pyrazol-5-yl]benzonitrile
• Benzonitrile, 2-[1-methyl-3-(trifluoromethyl)-1H-pyrazol-5-yl]-

2-[1-Methyl-3-(trifluoromethyl)-1H-pyrazol-5-yl]benzonitrile

CAS: 910037-17-1

2-[1-Methyl-3-(trifluoromethyl)-1H-pyrazol-5-yl]benzonitrile

Purity: 95%

Molecular weight: 251.21g/mol

Ref: 54-PC8557