2-(2-Methyl-2-propen-1-yl)benzonitrile
[CAS# 97780-98-8]

Identification

• Name: 2-(2-Methyl-2-propen-1-yl)benzonitrile
• Synonyms: 2-(2-Methylallyl)benzonitrile; 3-(2-Cyanophenyl)-2-methyl-1-propene; 3-(2-Cyanophenyl)-2-methylprop-1-ene
• Molecular Formula: C₁₁H₁₁N
• Molecular Weight: 157.21
• CAS Registry Number: 97780-98-8
• SMILES: C=C(C)Cc1ccccc1C#N
• InChI: 1S/C11H11N/c1-9(2)7-10-5-3-4-6-11(10)8-12/h3-6H,1,7H2,2H3
• InChIKey: GBDRLTMHKWOQSX-UHFFFAOYSA-N

Properties

• Density: 0.978g/cm³ (Cal.)
• Boiling point: 246.737°C at 760 mmHg (Cal.)
• Flash point: 103.009°C (Cal.)

Safety Data

• Safety Description: Toxic