9-Azatricyclo[5.3.1.0^2,6]Undec-9-Ylacetonitrile
[CAS# 59454-92-1]

Identification

• Name: 9-Azatricyclo[5.3.1.0^2,6]Undec-9-Ylacetonitrile
• Synonyms: 2-(octahydro-1,5-methanocyclopenta[d]azepin-3(2H)-yl)acetonitrile
• Molecular Formula: C₁₂H₁₈N₂
• Molecular Weight: 190.28
• CAS Registry Number: 59454-92-1
• SMILES: C1CC2C(C1)C3CC2CN(C3)CC#N
• InChI: 1S/C12H18N2/c13-4-5-14-7-9-6-10(8-14)12-3-1-2-11(9)12/h9-12H,1-3,5-8H2
• InChIKey: JULLISRVOZVRFO-UHFFFAOYSA-N

Properties

• Density: 1.062g/cm³ (Cal.)
• Boiling point: 302.814°C at 760 mmHg (Cal.)
• Flash point: 125.645°C (Cal.)