Tropacine
[CAS# 548-64-1]

Identification

• Name: Tropacine
• Synonyms: 2,2-Diphenylacetic Acid [(1S,5R)-8-Methyl-8-Azabicyclo[3.2.1]Octan-3-Yl] Ester Hydrochloride; [(1S,5R)-8-Methyl-8-Azabicyclo[3.2.1]Octan-3-Yl] 2,2-Diphenylethanoate Hydrochloride; Tropacin Hydrochloride
• Molecular Formula: C₂₂H₂₆ClNO₂
• Molecular Weight: 371.91
• CAS Registry Number: 548-64-1
• SMILES: [C@@H]14N([C@@H](CC1)CC(OC(=O)C(C2=CC=CC=C2)C3=CC=CC=C3)C4)C.[H+].[Cl-]
• InChI: 1S/C22H25NO2.ClH/c1-23-18-12-13-19(23)15-20(14-18)25-22(24)21(16-8-4-2-5-9-16)17-10-6-3-7-11-17;/h2-11,18-21H,12-15H2,1H3;1H/t18-,19+,20?
• InChIKey: JUFVBYPDDWKLQF-IIPFOPBBSA-N

Properties

• Boiling point: 447.3°C at 760 mmHg (Cal.)
• Flash point: 142°C (Cal.)