[(4R,4aR,7S,7aR,12bS)-7-Hydroxy-3-Methyl-2,4,4A,5,6,7,7A,13-Octahydro-1H-4,12-Methanobenzofuro[3,2-e]Isoquinoline-9-Yl] Acetate
[CAS# 58752-60-6]

Identification

• Name: [(4R,4aR,7S,7aR,12bS)-7-Hydroxy-3-Methyl-2,4,4A,5,6,7,7A,13-Octahydro-1H-4,12-Methanobenzofuro[3,2-e]Isoquinoline-9-Yl] Acetate
• Synonyms: (5α,6α)-4,5-epoxy-6-hydroxy-17-methylmorphinan-3-yl acetate
• Molecular Formula: C₁₉H₂₃NO₄
• Molecular Weight: 329.39
• CAS Registry Number: 58752-60-6
• EINECS: 261-421-5
• SMILES: CC(=O)Oc4ccc5C[C@H]3N(C)CC[C@@]21c5c4O[C@H]1[C@@H](O)CC[C@H]23
• InChI: 1S/C19H23NO4/c1-10(21)23-15-6-3-11-9-13-12-4-5-14(22)18-19(12,7-8-20(13)2)16(11)17(15)24-18/h3,6,12-14,18,22H,4-5,7-9H2,1-2H3/t12-,13+,14-,18-,19-/m0/s1
• InChIKey: KEJODKYTBSFQKS-LEPYJNQMSA-N

Properties

• Density: 1.359g/cm³ (Cal.)
• Boiling point: 494.768°C at 760 mmHg (Cal.)
• Flash point: 253.027°C (Cal.)