Thebaine Hydrochloride Monohydrate
[CAS# 5967-74-8]

Identification

• Name: Thebaine Hydrochloride Monohydrate
• Synonyms: Thebaine Hydrochloride Monohydrate
• Molecular Formula: C₁₉H₂₄ClNO₄
• Molecular Weight: 365.86
• CAS Registry Number: 5967-74-8
• SMILES: [C@@H]15CC4=C3[C@@]2(C1=CC=C([C@@H]2OC3=C(C=C4)OC)OC)CCN5C.[H+].[Cl-].O
• InChI: 1S/C19H21NO3.ClH.H2O/c1-20-9-8-19-12-5-7-15(22-3)18(19)23-17-14(21-2)6-4-11(16(17)19)10-13(12)20;;/h4-7,13,18H,8-10H2,1-3H3;1H;1H2/t13-,18+,19+;;/m1../s1
• InChIKey: GTDQNOOQGSLCNE-GBTORLPQSA-N

Properties

• Boiling point: 467.6°C at 760 mmHg (Cal.)
• Flash point: 141°C (Cal.)