CAS 132741-32-3

3,5-Difluoro-α-hydroxybenzeneacetonitrile

Description:

3,5-Difluoro-α-hydroxybenzeneacetonitrile, with the CAS number 132741-32-3, is an organic compound characterized by the presence of both fluorine substituents and a hydroxyl group on a benzene ring, along with a nitrile functional group. The molecular structure features a benzene ring with two fluorine atoms located at the 3 and 5 positions, which can influence the compound's reactivity and polarity. The α-hydroxy group contributes to its potential as a chiral center, affecting its stereochemistry and interactions in biological systems. The acetonitrile moiety introduces a nitrile functional group, which is known for its ability to participate in various chemical reactions, including nucleophilic additions and condensation reactions. This compound may exhibit unique physical properties, such as solubility in polar solvents, and could be of interest in pharmaceutical applications or as an intermediate in organic synthesis. Its fluorinated nature may also impart specific electronic properties, making it a subject of study in materials science and medicinal chemistry.

Formula: C₈H₅F₂NO

InChI: InChI=1S/C8H5F2NO/c9-6-1-5(8(12)4-11)2-7(10)3-6/h1-3,8,12H

InChI key: InChIKey=JDPJXNHYKGCGSY-UHFFFAOYSA-N

SMILES: C(C#N)(O)C1=CC(F)=CC(F)=C1

Synonyms:

• 3,5-Difluoro-α-hydroxybenzeneacetonitrile
• Benzeneacetonitrile, 3,5-difluoro-α-hydroxy-
• 2-(3,5-Difluorophenyl)-2-hydroxyacetonitrile