3-O-Tert-Butylmorphine
[CAS# 34332-27-9]

Identification

• Name: 3-O-Tert-Butylmorphine
• Synonyms: Morphinan-6-Ol, 7,8-Didehydro-3-(1,1-Dimethylethoxy)-4,5-Epoxy-17-Methyl-, (5Alpha,6Alpha)-
• Molecular Formula: C₂₁H₂₇NO₃
• Molecular Weight: 341.45
• CAS Registry Number: 34332-27-9
• SMILES: [C@@H]15CC4=C3[C@@]2([C@H]1C=C[C@@H]([C@@H]2OC3=C(C=C4)OC(C)(C)C)O)CCN5C
• InChI: 1S/C21H27NO3/c1-20(2,3)25-16-8-5-12-11-14-13-6-7-15(23)19-21(13,9-10-22(14)4)17(12)18(16)24-19/h5-8,13-15,19,23H,9-11H2,1-4H3/t13-,14+,15-,19-,21-/m0/s1
• InChIKey: KGAFKGNBYPHAJK-JIDSPLGISA-N

Properties

• Density: 1.257g/cm³ (Cal.)
• Boiling point: 482.517°C at 760 mmHg (Cal.)
• Flash point: 245.618°C (Cal.)