3-O-Propanoylmorphine
[CAS# 66640-97-9]

Identification

• Name: 3-O-Propanoylmorphine
• Synonyms: Morphinan-3,6-Diol, 7,8-Didehydro-4,5-Epoxy-17-Methyl-, (5Alpha,6Alpha)-, 3-Propanoate
• Molecular Formula: C₂₀H₂₃NO₄
• Molecular Weight: 341.41
• CAS Registry Number: 66640-97-9
• SMILES: [C@H]12C5CC4=C3[C@]1([C@H]([C@H](C=C2)O)OC3=C(C=C4)OC(CC)=O)CCN5C
• InChI: 1S/C20H23NO4/c1-3-16(23)24-15-7-4-11-10-13-12-5-6-14(22)19-20(12,8-9-21(13)2)17(11)18(15)25-19/h4-7,12-14,19,22H,3,8-10H2,1-2H3/t12-,13?,14-,19-,20-/m0/s1
• InChIKey: LSYABJYKSBROSB-ZMWMKAGOSA-N

Properties

• Density: 1.355g/cm³ (Cal.)
• Boiling point: 504.398°C at 760 mmHg (Cal.)
• Flash point: 258.851°C (Cal.)