Nalmexonum
[CAS# 16676-26-9]

Identification

• Name: Nalmexonum
• Synonyms: 4,5Alpha-Epoxy-3,14-Dihydroxy-N-(3-Methyl-2-Butenyl)-6-Morphinanon; 7,7A,8,9-Tetrahydro-3,7A-Dihydroxy-12-(3-Methyl-2-Butenyl)-6H-8,9C-Iminoethanophenantro(4,5-Bcd)Furan-5(4Alphah)-On; 7,8-Dihydro-14-Hydroxy-N-(3-Methyl-2-Butenyl)Normorphinone
• Molecular Formula: C₂₁H₂₅NO₄
• Molecular Weight: 355.43
• CAS Registry Number: 16676-26-9
• SMILES: [C@@]125C3=C4C[C@H]([C@@]1(CCC([C@@H]2OC3=C(C=C4)O)=O)O)N(CC=C(C)C)CC5
• InChI: 1S/C21H25NO4/c1-12(2)6-9-22-10-8-20-17-13-3-4-14(23)18(17)26-19(20)15(24)5-7-21(20,25)16(22)11-13/h3-4,6,16,19,23,25H,5,7-11H2,1-2H3/t16-,19+,20+,21-/m1/s1
• InChIKey: OHKCLOQPSLQCQR-MBPVOVBZSA-N

Properties

• Density: 1.376g/cm³ (Cal.)
• Boiling point: 550.452°C at 760 mmHg (Cal.)
• Flash point: 286.703°C (Cal.)