3-(trans-4-Propylcyclohexyl)-2-Propynenitrile
[CAS# 280122-12-5]

Identification

• Name: 3-(trans-4-Propylcyclohexyl)-2-Propynenitrile
• Synonyms: 3-((1s,4r)-4-propylcyclohexyl)propiolonitrile
• Molecular Formula: C₁₂H₁₇N
• Molecular Weight: 175.27
• CAS Registry Number: 280122-12-5
• SMILES: CCC[C@H]1CC[C@@H](CC1)C#CC#N
• InChI: 1S/C12H17N/c1-2-4-11-6-8-12(9-7-11)5-3-10-13/h11-12H,2,4,6-9H2,1H3/t11-,12-
• InChIKey: UPMVRSJPGQQSER-HAQNSBGRSA-N

Properties

• Density: 0.9±0.1g/cm³ (Cal.)
• Boiling point: 261.6±23.0°C at 760 mmHg (Cal.)
• Flash point: 103.4±16.5°C (Cal.)
• Refractive index: 1.485 (Cal.)