Xorphanol
[CAS# 77287-89-9]

Identification

• Name: Xorphanol
• Synonyms: 9A-Cyclobutylmethyl-8Beta-Methyl-6-Methylen-3-Morphinanol; Morphinan-3-Ol, 17-(Cyclobutylmethyl)-8-Methyl-6-Methylene-, (8Beta)-; N-(Cyclobutylmethyl)-8 Beta-Methyl-6-Methylenemorphinan-3-Ol
• Molecular Formula: C₂₃H₃₁NO
• Molecular Weight: 337.50
• CAS Registry Number: 77287-89-9
• SMILES: [C@]135[C@H]([C@H](N(CC1)CC2CCC2)CC4=C3C=C(O)C=C4)[C@H](CC(C5)=C)C
• InChI: 1S/C23H31NO/c1-15-10-16(2)22-21-11-18-6-7-19(25)12-20(18)23(22,13-15)8-9-24(21)14-17-4-3-5-17/h6-7,12,16-17,21-22,25H,1,3-5,8-11,13-14H2,2H3/t16-,21+,22-,23+/m0/s1
• InChIKey: AZJPPZHRNFQRRE-AZIXLERZSA-N

Properties

• Density: 1.149g/cm³ (Cal.)
• Boiling point: 476.477°C at 760 mmHg (Cal.)
• Flash point: 228.358°C (Cal.)