Nicomorphine
[CAS# 639-48-5]

Identification

• Name: Nicomorphine
• Molecular Formula: C₂₉H₂₆ClN₃O₅
• Molecular Weight: 531.99
• CAS Registry Number: 639-48-5
• EINECS: 211-357-9
• SMILES: [C@]245[C@H]6OC3=C(OC(=O)C1=CN=CC=C1)C=CC(=C23)C[C@@H](N(CC4)C)[C@@H]5C=C[C@@H]6OC(=O)C7=CN=CC=C7.[H+].[Cl-]
• InChI: 1S/C29H25N3O5.ClH/c1-32-13-10-29-20-7-9-23(36-28(34)19-5-3-12-31-16-19)26(29)37-25-22(8-6-17(24(25)29)14-21(20)32)35-27(33)18-4-2-11-30-15-18;/h2-9,11-12,15-16,20-21,23,26H,10,13-14H2,1H3;1H/t20-,21+,23-,26-,29-;/m0./s1
• InChIKey: LYSPLNOMQZTGCM-IOZAQTAYSA-N

Properties

• Boiling point: 687.7°C at 760 mmHg (Cal.)
• Flash point: 369.7°C (Cal.)

Safety Data

• Controlled Substance: DEA Drug Code Number: 9312