N-(1-Azabicyclo(2.2.2)octan-3-yl)-8-chloro-2,6-methano-3,4,5,6-tetrahydro-2H-1-benzoxocin-10-carboxamide
[CAS# 141979-80-8]

Identification

• Name: N-(1-Azabicyclo(2.2.2)octan-3-yl)-8-chloro-2,6-methano-3,4,5,6-tetrahydro-2H-1-benzoxocin-10-carboxamide
• Synonyms: 2,6-Methano-2H-1-Benzoxocin-10-Carboxamide, N-1-Azabicyclo(2.2.2)Oct-3-Yl-8-Chloro-3,4,5,6-Tetrahydro-, (2S-(2Alpha,6Alpha,10(R*)))-; N-(1-Azabicyclo(2.2.2)Octan-3-Yl)-8-Chloro-2,6-Methano-3,4,5,6-Tetrahydro-2H-1-Benzoxocin-10-Carboxamide
• Molecular Formula: C₂₀H₂₅ClN₂O₂
• Molecular Weight: 360.88
• CAS Registry Number: 141979-80-8
• SMILES: [C@H]45OC1=C(C(=C(C=C1C(=O)N)Cl)C2CN3CCC2CC3)[C@H](CCC4)C5
• InChI: 1S/C20H25ClN2O2/c21-16-9-14(20(22)24)19-17(12-2-1-3-13(8-12)25-19)18(16)15-10-23-6-4-11(15)5-7-23/h9,11-13,15H,1-8,10H2,(H2,22,24)/t12-,13+,15?/m1/s1
• InChIKey: YPNHVPTXMYZJQO-NEJHNUGDSA-N

Properties

• Density: 1.341g/cm³ (Cal.)
• Boiling point: 424.759°C at 760 mmHg (Cal.)
• Flash point: 210.687°C (Cal.)