3-Benzyl-8-Propionyl-3,8-Diazabicyclo[3.2.1]Octane
[CAS# 63978-12-1]

Identification

• Name: 3-Benzyl-8-Propionyl-3,8-Diazabicyclo[3.2.1]Octane
• Synonyms: 1-[3-(Benzyl)-3,8-Diazabicyclo[3.2.1]Octan-8-Yl]Propan-1-One; 3,8-Diazabicyclo(3.2.1)Octane, 3-Benzyl-8-Propionyl-; 3-Benzyl-8-Propionyl-3,8-Diazabicyclo(3.2.1)Octane
• Molecular Formula: C₁₆H₂₂N₂O
• Molecular Weight: 258.36
• CAS Registry Number: 63978-12-1
• SMILES: C3=C(CN1CC2N(C(C1)CC2)C(CC)=O)C=CC=C3
• InChI: 1S/C16H22N2O/c1-2-16(19)18-14-8-9-15(18)12-17(11-14)10-13-6-4-3-5-7-13/h3-7,14-15H,2,8-12H2,1H3
• InChIKey: MAQBLRFYCNOQJD-UHFFFAOYSA-N

Properties

• Density: 1.118g/cm³ (Cal.)
• Boiling point: 400.7°C at 760 mmHg (Cal.)
• Flash point: 170.52°C (Cal.)