CAS 1867-37-4

2-(Phenylmethyl)propanedinitrile

Description:

2-(Phenylmethyl)propanedinitrile, also known by its CAS number 1867-37-4, is an organic compound characterized by the presence of two nitrile (–C≡N) functional groups attached to a propanediol backbone, with a phenylmethyl group (benzyl group) substituent. This compound typically appears as a colorless to pale yellow liquid or solid, depending on its purity and temperature. It is known for its relatively low solubility in water but is soluble in organic solvents such as ethanol and acetone. The presence of nitrile groups contributes to its reactivity, making it a useful intermediate in organic synthesis, particularly in the production of pharmaceuticals and agrochemicals. Additionally, the compound may exhibit specific physical properties such as boiling and melting points that are influenced by its molecular structure. Safety data indicates that it should be handled with care, as it may pose health risks upon exposure. Overall, 2-(Phenylmethyl)propanedinitrile is a versatile compound with applications in various chemical syntheses.

Formula: C₁₀H₈N₂

InChI: InChI=1S/C10H8N2/c11-7-10(8-12)6-9-4-2-1-3-5-9/h1-5,10H,6H2

InChI key: InChIKey=ODFHXXQVNHHDDG-UHFFFAOYSA-N

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

Synonyms:

• 2-(Phenylmethyl)propanedinitrile
• Propanedinitrile, (phenylmethyl)-
• Benzylmalononitrile
• Propanedinitrile, 2-(phenylmethyl)-
• Malononitrile, benzyl-