(3R,6R)-3-Acetoxy-6-dimethylamino-4,4-diphenylheptane
[CAS# 17199-58-5]

Identification

• Name: (3R,6R)-3-Acetoxy-6-dimethylamino-4,4-diphenylheptane
• Synonyms: [(1R,4R)-4-Dimethylamino-1-Ethyl-2,2-Di(Phenyl)Pentyl] Acetate; Acetic Acid [(1R,4R)-4-Dimethylamino-1-Ethyl-2,2-Di(Phenyl)Pentyl] Ester; [(3R,6R)-6-Dimethylamino-4,4-Di(Phenyl)Heptan-3-Yl] Ethanoate
• Molecular Formula: C₂₃H₃₁NO₂
• Molecular Weight: 353.50
• CAS Registry Number: 17199-58-5
• SMILES: [C@@H](C(C1=CC=CC=C1)(C2=CC=CC=C2)C[C@H](N(C)C)C)(OC(C)=O)CC
• InChI: 1S/C23H31NO2/c1-6-22(26-19(3)25)23(17-18(2)24(4)5,20-13-9-7-10-14-20)21-15-11-8-12-16-21/h7-16,18,22H,6,17H2,1-5H3/t18-,22-/m1/s1
• InChIKey: XBMIVRRWGCYBTQ-XMSQKQJNSA-N

Properties

• Density: 1.021g/cm³ (Cal.)
• Boiling point: 455.959°C at 760 mmHg (Cal.)
• Flash point: 129.969°C (Cal.)

Safety Data

• Controlled Substance: DEA Drug Code Number: 9603