(5alpha,6alpha)-3-Methoxy-17-methyl-4,5-epoxymorphinan-6-yl thiocyanate
[CAS# 84824-87-3]

Identification

• Name: (5alpha,6alpha)-3-Methoxy-17-methyl-4,5-epoxymorphinan-6-yl thiocyanate
• Synonyms: (5α,6α)-4,5-epoxy-3-methoxy-17-methylmorphinan-6-yl thiocyanate
• Molecular Formula: C₁₉H₂₂N₂O₂S
• Molecular Weight: 342.46
• CAS Registry Number: 84824-87-3
• EINECS: 284-239-8
• SMILES: N#CS[C@H]1CC[C@H]3[C@H]2Cc5ccc(OC)c4O[C@@H]1[C@]3(CCN2C)c45
• InChI: 1S/C19H22N2O2S/c1-21-8-7-19-12-4-6-15(24-10-20)18(19)23-17-14(22-2)5-3-11(16(17)19)9-13(12)21/h3,5,12-13,15,18H,4,6-9H2,1-2H3/t12-,13+,15-,18-,19-/m0/s1
• InChIKey: YOHUSUMHNADSOZ-SSTWWWIQSA-N

Properties

• Density: 1.34g/cm³ (Cal.)
• Boiling point: 513.907°C at 760 mmHg (Cal.)
• Flash point: 264.602°C (Cal.)