3-(2-Methyl-2-propen-1-yl)benzonitrile
[CAS# 731772-73-9]

Identification

• Name: 3-(2-Methyl-2-propen-1-yl)benzonitrile
• Synonyms: 3-(3-cyanophenyl)-2-methyl-1-propene
• Molecular Formula: C₁₁H₁₁N
• Molecular Weight: 157.21
• CAS Registry Number: 731772-73-9
• SMILES: C=C(C)Cc1cccc(c1)C#N
• InChI: 1S/C11H11N/c1-9(2)6-10-4-3-5-11(7-10)8-12/h3-5,7H,1,6H2,2H3
• InChIKey: ATKHVPPPYPSHNE-UHFFFAOYSA-N

Properties

• Density: 0.978g/cm³ (Cal.)
• Boiling point: 252.226°C at 760 mmHg (Cal.)
• Flash point: 106.373°C (Cal.)
• Refractive index: 1.526 (Cal.)