CAS 866042-32-2

2-Chloro-α-(4-chlorophenyl)-5-methyl-4-nitrobenzeneacetonitrile

Description:

2-Chloro-α-(4-chlorophenyl)-5-methyl-4-nitrobenzeneacetonitrile, with the CAS number 866042-32-2, is a synthetic organic compound characterized by its complex structure, which includes a chloro group, a nitro group, and an acetonitrile functional group. This compound typically appears as a solid at room temperature and is known for its potential applications in pharmaceuticals and agrochemicals due to its unique chemical properties. The presence of multiple halogen and nitro substituents suggests that it may exhibit significant reactivity, particularly in electrophilic substitution reactions. Additionally, the compound's structure indicates potential for interactions with biological systems, making it of interest in medicinal chemistry. Its solubility and stability can vary depending on the solvent and environmental conditions, which are important factors to consider in practical applications. Safety data should be reviewed, as halogenated compounds can pose health risks, and appropriate handling procedures should be followed.

Formula: C₁₅H₁₀Cl₂N₂O₂

InChI: InChI=1S/C15H10Cl2N2O2/c1-9-6-12(14(17)7-15(9)19(20)21)13(8-18)10-2-4-11(16)5-3-10/h2-7,13H,1H3

InChI key: InChIKey=ZZZRTFVXVVEQGQ-UHFFFAOYSA-N

SMILES: C(C#N)(C1=C(Cl)C=C(N(=O)=O)C(C)=C1)C2=CC=C(Cl)C=C2

Synonyms:

• 2-Chloro-α-(4-chlorophenyl)-5-methyl-4-nitrobenzeneacetonitrile
• Benzeneacetonitrile, 2-chloro-α-(4-chlorophenyl)-5-methyl-4-nitro-