(2alpha,6alpha,11R*)-3-Benzyl-1,2,3,4,5,6-Hexahydro-6,11-Dimethyl-2,6-Methano-3-Benzazocin-8-Ol
[CAS# 58072-89-2]

Identification

• Name: (2alpha,6alpha,11R*)-3-Benzyl-1,2,3,4,5,6-Hexahydro-6,11-Dimethyl-2,6-Methano-3-Benzazocin-8-Ol
• Synonyms: (2Alpha,6Alpha,11R*)-3-Benzyl-1,2,3,4,5,6-Hexahydro-6,11-Dimethyl-2,6-Methano-3-Benzazocin-8-Ol; Einecs 260-817-5
• Molecular Formula: C₂₁H₂₅NO
• Molecular Weight: 307.43
• CAS Registry Number: 58072-89-2
• EINECS: 261-097-5
• SMILES: [C@@]13(C4=C(C[C@H](N(CC1)CC2=CC=CC=C2)C3C)C=CC(=C4)O)C
• InChI: 1S/C21H25NO/c1-15-20-12-17-8-9-18(23)13-19(17)21(15,2)10-11-22(20)14-16-6-4-3-5-7-16/h3-9,13,15,20,23H,10-12,14H2,1-2H3/t15?,20-,21-/m0/s1
• InChIKey: RPMPAQXGZYLEST-LBTAZEDMSA-N

Properties

• Density: 1.126g/cm³ (Cal.)
• Boiling point: 442.112°C at 760 mmHg (Cal.)
• Flash point: 211.029°C (Cal.)