Mersyndol
[CAS# 100216-57-7]

Identification

• Name: Mersyndol
• Synonyms: Morphinan-6-Ol, 7,8-Didehydro-4,5-Epoxy-3-Methoxy-17-Methyl-, (5Alpha,6Alpha)-, Phosphate (1:1) (Salt), Mixt. With N,N-Dimethyl-2-(1-Phenyl-1-(2-Pyridinyl)Ethoxy)Ethanamine Butanedioate (1:1) And N-(4-Hydroxyphenyl)Acetamide
• Molecular Formula: C₄₇H₆₁N₄O₁₄P
• Molecular Weight: 936.99
• CAS Registry Number: 100216-57-7
• SMILES: N(C1=CC=C(O)C=C1)C(=O)C.[C@]245[C@H]6OC3=C(OC)C=CC(=C23)C[C@@H](N(CC4)C)[C@@H]5C=C[C@@H]6O.O=[P](O)(O)O.C(OC(C7=CC=CC=N7)(C8=CC=CC=C8)C)CN(C)C.C(C(=O)O)CC(=O)O
• InChI: 1S/C18H21NO3.C17H22N2O.C8H9NO2.C4H6O4.H3O4P/c1-19-8-7-18-11-4-5-13(20)17(18)22-16-14(21-2)6-3-10(15(16)18)9-12(11)19;1-17(20-14-13-19(2)3,15-9-5-4-6-10-15)16-11-7-8-12-18-16;1-6(10)9-7-2-4-8(11)5-3-7;5-3(6)1-2-4(7)8;1-5(2,3)4/h3-6,11-13,17,20H,7-9H2,1-2H3;4-12H,13-14H2,1-3H3;2-5,11H,1H3,(H,9,10);1-2H2,(H,5,6)(H,7,8);(H3,1,2,3,4)/t11-,12+,13-,17-,18-;;;;/m0..../s1
• InChIKey: UIEXGALYZIJPJA-IDOSJLLWSA-N

Properties

• Boiling point: 462°C at 760 mmHg (Cal.)
• Flash point: 233.2°C (Cal.)