2-(1-Azabicyclo[2.2.2]Oct-3-Yl)-2,3,3A,4,5,6-Hexahydro-1H-Benzo[de]Isoquinolin-1-One
[CAS# 135729-60-1]

Identification

• Name: 2-(1-Azabicyclo[2.2.2]Oct-3-Yl)-2,3,3A,4,5,6-Hexahydro-1H-Benzo[de]Isoquinolin-1-One
• Synonyms: 2-(quinuclidin-3-yl)-2,3,3a,4,5,6-hexahydro-1H-benzo[de]isoquinolin-1-one
• Molecular Formula: C₁₉H₂₄N₂O
• Molecular Weight: 296.41
• CAS Registry Number: 135729-60-1
• SMILES: O=C5N(C2C1CCN(CC1)C2)CC4c3c5cccc3CCC4
• InChI: 1S/C19H24N2O/c22-19-16-6-2-4-14-3-1-5-15(18(14)16)11-21(19)17-12-20-9-7-13(17)8-10-20/h2,4,6,13,15,17H,1,3,5,7-12H2
• InChIKey: CPZBLNMUGSZIPR-UHFFFAOYSA-N

Properties

• Density: 1.242g/cm³ (Cal.)
• Boiling point: 470.414°C at 760 mmHg (Cal.)
• Flash point: 209.529°C (Cal.)
• Refractive index: 1.646 (Cal.)