1-Ethyl-4-phenyl-4-azepanecarbonitrile
[CAS# 801156-61-6]

Identification

• Name: 1-Ethyl-4-phenyl-4-azepanecarbonitrile
• Synonyms: 1-ethyl-4-phenylazepane-4-carbonitrile; AIDS130246; AIDS-130246
• Molecular Formula: C₁₅H₂₀N₂
• Molecular Weight: 228.33
• CAS Registry Number: 801156-61-6
• SMILES: CCN1CCCC(CC1)(C#N)C2=CC=CC=C2
• InChI: 1S/C15H20N2/c1-2-17-11-6-9-15(13-16,10-12-17)14-7-4-3-5-8-14/h3-5,7-8H,2,6,9-12H2,1H3
• InChIKey: VGTIIMMLFBZHTQ-UHFFFAOYSA-N

Properties

• Density: 1.0±0.1g/cm³ (Cal.)
• Boiling point: 363.5±42.0°C at 760 mmHg (Cal.)
• Flash point: 152.7±17.1°C (Cal.)
• Refractive index: 1.552 (Cal.)