CAS 900175-14-6

2,4-Difluoro-α-hydroxy-5-methoxybenzeneacetonitrile

Description:

2,4-Difluoro-α-hydroxy-5-methoxybenzeneacetonitrile, with the CAS number 900175-14-6, is a chemical compound characterized by its unique structure that includes a benzene ring substituted with two fluorine atoms, a methoxy group, and a hydroxyl group, along with an acetonitrile functional group. This compound is likely to exhibit polar characteristics due to the presence of the hydroxyl and methoxy groups, which can engage in hydrogen bonding. The difluorination introduces significant electronegativity, potentially affecting the compound's reactivity and interaction with biological systems. It may be soluble in polar solvents, and its molecular structure suggests potential applications in pharmaceuticals or agrochemicals, particularly in the development of compounds with specific biological activities. The presence of the acetonitrile group indicates that it may also participate in nucleophilic reactions. Overall, the compound's unique functional groups and substituents contribute to its chemical behavior and potential utility in various chemical applications.

Formula: C₉H₇F₂NO₂

InChI: InChI=1S/C9H7F2NO2/c1-14-9-2-5(8(13)4-12)6(10)3-7(9)11/h2-3,8,13H,1H3

InChI key: InChIKey=PYUVLQPIHAXOPJ-UHFFFAOYSA-N

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

Synonyms:

• Benzeneacetonitrile, 2,4-difluoro-α-hydroxy-5-methoxy-
• 2,4-Difluoro-α-hydroxy-5-methoxybenzeneacetonitrile
• 2-(2,4-Difluoro-5-methoxyphenyl)-2-hydroxyacetonitrile