14-Chloroacetylnaltrexone
[CAS# 82975-76-6]

Identification

• Name: 14-Chloroacetylnaltrexone
• Synonyms: Morphinan-6-One, 14-((Chloroacetyl)Oxy)-17-(Cyclopropylmethyl)-4,5-Epoxy-3-Hydroxy-, (5Alpha)-
• Molecular Formula: C₂₂H₂₄ClNO₅
• Molecular Weight: 417.89
• CAS Registry Number: 82975-76-6
• SMILES: [C@@H]24C35C1=C(C=CC(=C1O2)O)CC(C3(CCC4=O)OC(=O)CCl)N(CC5)CC6CC6
• InChI: 1S/C22H24ClNO5/c23-10-17(27)29-22-6-5-15(26)20-21(22)7-8-24(11-12-1-2-12)16(22)9-13-3-4-14(25)19(28-20)18(13)21/h3-4,12,16,20,25H,1-2,5-11H2/t16?,20-,21?,22?/m1/s1
• InChIKey: RBLRREDDNIMVKU-PGWLQHKVSA-N

Properties

• Density: 1.492g/cm³ (Cal.)
• Boiling point: 587.704°C at 760 mmHg (Cal.)
• Flash point: 309.233°C (Cal.)