6-Bromoacetamido-6-Desoxynaltrexone
[CAS# 91409-49-3]

Identification

• Name: 6-Bromoacetamido-6-Desoxynaltrexone
• Molecular Formula: C₂₂H₂₇BrN₂O₄
• Molecular Weight: 463.37
• CAS Registry Number: 91409-49-3
• SMILES: [C@@H]26OC1=C(C=CC3=C1[C@]24[C@]([C@@H](C3)N(CC4)CC5CC5)(CC[C@H]6NC(CBr)=O)O)O
• InChI: 1S/C22H27BrN2O4/c23-10-17(27)24-14-5-6-22(28)16-9-13-3-4-15(26)19-18(13)21(22,20(14)29-19)7-8-25(16)11-12-1-2-12/h3-4,12,14,16,20,26,28H,1-2,5-11H2,(H,24,27)/t14-,16-,20+,21+,22-/m1/s1
• InChIKey: LLJPZWYDUXHCIX-HAOCKTTRSA-N

Properties

• Density: 1.629g/cm³ (Cal.)
• Boiling point: 671.249°C at 760 mmHg (Cal.)
• Flash point: 359.759°C (Cal.)