(E)-N-Butyl-N-(8-Methyl-8-Azabicyclo[3.2.1]Octan-3-Yl)-3-Phenylprop-2-Enamide Hydrochloride
[CAS# 171261-31-7]

Identification

• Name: (E)-N-Butyl-N-(8-Methyl-8-Azabicyclo[3.2.1]Octan-3-Yl)-3-Phenylprop-2-Enamide Hydrochloride
• Synonyms: (E)-N-Butyl-N-(8-Methyl-8-Azabicyclo[3.2.1]Octan-3-Yl)-3-Phenyl-Prop-2-Enamide Hydrochloride; (E)-N-Butyl-N-(8-Methyl-8-Azabicyclo[3.2.1]Octan-3-Yl)-3-Phenyl-Acrylamide Hydrochloride; 2-Propenamide, N-Butyl-N-(8-Methyl-8-Azabicyclo(3.2.1)Oct-3-Yl)-3-Phenyl-, Hydrochloride, Hydrate (2:2:1), Endo-
• Molecular Formula: C₂₁H₃₁ClN₂O
• Molecular Weight: 362.94
• CAS Registry Number: 171261-31-7
• SMILES: [H+].C3=C(/C=C/C(=O)N(C1CC2N(C(C1)CC2)C)CCCC)C=CC=C3.[Cl-]
• InChI: 1S/C21H30N2O.ClH/c1-3-4-14-23(20-15-18-11-12-19(16-20)22(18)2)21(24)13-10-17-8-6-5-7-9-17;/h5-10,13,18-20H,3-4,11-12,14-16H2,1-2H3;1H/b13-10+
• InChIKey: PIRCALUPZAXTFN-RSGUCCNWSA-N

Properties

• Boiling point: 488.5°C at 760 mmHg (Cal.)
• Flash point: 203.2°C (Cal.)