{1-[(1E)-1,3-Butadien-1-yl]cyclohexyl}acetonitrile
[CAS# 748771-58-6]

Identification

• Name: {1-[(1E)-1,3-Butadien-1-yl]cyclohexyl}acetonitrile
• Synonyms: (E)-2-(1-(buta-1,3-dien-1-yl)cyclohexyl)acetonitrile
• Molecular Formula: C₁₂H₁₇N
• Molecular Weight: 175.27
• CAS Registry Number: 748771-58-6
• SMILES: N#CCC1(\C=C\C=C)CCCCC1
• InChI: 1S/C12H17N/c1-2-3-7-12(10-11-13)8-5-4-6-9-12/h2-3,7H,1,4-6,8-10H2/b7-3+
• InChIKey: YWYKNRGNOPVIGM-XVNBXDOJSA-N

Properties

• Density: 0.956g/cm³ (Cal.)
• Boiling point: 288.894°C at 760 mmHg (Cal.)
• Flash point: 133.798°C (Cal.)
• Refractive index: 1.533 (Cal.)