7,8-Didehydro-4,5alpha-Epoxy-3-Methoxy-17-Methylmorphinan-6beta-Ol Acetate
[CAS# 63783-54-0]

Identification

• Name: 7,8-Didehydro-4,5alpha-Epoxy-3-Methoxy-17-Methylmorphinan-6beta-Ol Acetate
• Synonyms: Isocodeine, Acetyl-; Morphinan-6-Beta-Ol, 7,8-Didehydro-4,5-Alpha-Epoxy-3-Methoxy-17-Methyl-, Acetate
• Molecular Formula: C₂₀H₂₃NO₄
• Molecular Weight: 341.41
• CAS Registry Number: 63783-54-0
• SMILES: [C@@H]15CC4=C3[C@@]2([C@H]1C=C[C@H]([C@@H]2OC3=C(C=C4)OC)OC(C)=O)CCN5C
• InChI: 1S/C20H23NO4/c1-11(22)24-16-7-5-13-14-10-12-4-6-15(23-3)18-17(12)20(13,19(16)25-18)8-9-21(14)2/h4-7,13-14,16,19H,8-10H2,1-3H3/t13-,14+,16+,19-,20-/m0/s1
• InChIKey: MFXFQKMUCYHPFQ-ZLOUOWRTSA-N

Properties

• Density: 1.31g/cm³ (Cal.)
• Boiling point: 461.173°C at 760 mmHg (Cal.)
• Flash point: 232.709°C (Cal.)