Alphaprodine hydrochloride
[CAS# 561-78-4]

Identification

• Name: Alphaprodine hydrochloride
• Synonyms: [(3S,4R)-1,3-Dimethyl-4-Phenyl-4-Piperidyl] Propanoate Hydrochloride; Propanoic Acid [(3S,4R)-1,3-Dimethyl-4-Phenyl-4-Piperidinyl] Ester Hydrochloride; Propionic Acid [(3S,4R)-1,3-Dimethyl-4-Phenyl-4-Piperidyl] Ester Hydrochloride
• Molecular Formula: C₁₆H₂₄ClNO₂
• Molecular Weight: 297.82
• CAS Registry Number: 561-78-4
• SMILES: [C@@]1(OC(=O)CC)([C@H](CN(CC1)C)C)C2=CC=CC=C2.[H+].[Cl-]
• InChI: 1S/C16H23NO2.ClH/c1-4-15(18)19-16(14-8-6-5-7-9-14)10-11-17(3)12-13(16)2;/h5-9,13H,4,10-12H2,1-3H3;1H/t13-,16+;/m0./s1
• InChIKey: LFLUADVCIBEPQJ-MELYUZJYSA-N

Properties

• Boiling point: 338.4°C at 760 mmHg (Cal.)
• Flash point: 110.3°C (Cal.)