CAS 952958-86-0

3,5-Dichloro-2-methoxybenzeneacetonitrile

Description:

3,5-Dichloro-2-methoxybenzeneacetonitrile, with the CAS number 952958-86-0, is an organic compound characterized by its aromatic structure, which includes a methoxy group and two chlorine substituents on a benzene ring. This compound features a nitrile functional group (-C≡N) attached to an acetic acid derivative, contributing to its reactivity and potential applications in organic synthesis. The presence of chlorine atoms enhances its electrophilic properties, making it useful in various chemical reactions, including nucleophilic substitutions. The methoxy group can influence the compound's solubility and polarity, affecting its behavior in different solvents. Typically, compounds like this may exhibit moderate to high stability under standard conditions but can be sensitive to strong bases or nucleophiles. Its unique structure may also impart specific biological activities, making it of interest in pharmaceutical research. Safety data should be consulted for handling, as halogenated compounds can pose environmental and health risks.

Formula: C₉H₇Cl₂NO

InChI: InChI=1S/C9H7Cl2NO/c1-13-9-6(2-3-12)4-7(10)5-8(9)11/h4-5H,2H2,1H3

InChI key: InChIKey=MWKHYBMHQXRKEI-UHFFFAOYSA-N

SMILES: C(C#N)C1=C(OC)C(Cl)=CC(Cl)=C1

Synonyms:

• 2-(3,5-Dichloro-2-methoxyphenyl)acetonitrile
• Benzeneacetonitrile, 3,5-dichloro-2-methoxy-
• 3,5-Dichloro-2-methoxybenzeneacetonitrile
• (3,5-Dichloro-2-methoxyphenyl)acetonitrile