(5alpha,6alpha)-7,8-Didehydro-4,5-Epoxy-2-(Hydroxymethyl)-17-Methyl-Morphinan-3,6-Diol
[CAS# 198273-90-4]

Identification

• Name: (5alpha,6alpha)-7,8-Didehydro-4,5-Epoxy-2-(Hydroxymethyl)-17-Methyl-Morphinan-3,6-Diol
• Molecular Formula: C₁₈H₂₁NO₄
• Molecular Weight: 315.37
• CAS Registry Number: 198273-90-4
• SMILES: [C@@H]15CC4=C3[C@@]2([C@H]1C=C[C@@H]([C@@H]2OC3=C(C(=C4)CO)O)O)CCN5C
• InChI: 1S/C18H21NO4/c1-19-5-4-18-11-2-3-13(21)17(18)23-16-14(18)9(7-12(11)19)6-10(8-20)15(16)22/h2-3,6,11-13,17,20-22H,4-5,7-8H2,1H3/t11-,12+,13-,17-,18-/m0/s1
• InChIKey: KPTNEAFOTXBROR-DNJOTXNNSA-N

Properties

• Density: 1.496g/cm³ (Cal.)
• Boiling point: 528.644°C at 760 mmHg (Cal.)
• Flash point: 273.514°C (Cal.)