Mycosolon
[CAS# 78232-18-5]

Identification

• Name: Mycosolon
• Synonyms: 1-[2-(2,4-Dichlorophenyl)-2-[(2,4-Dichlorophenyl)Methoxy]Ethyl]Imidazole; (8S,9S,10R,11S,13S,14S,17R)-11,17-Dihydroxy-10,13-Dimethyl-17-[2-(4-Methyl-1-Piperazinyl)-1-Oxoethyl]-7,8,9,11,12,14,15,16-Octahydro-6H-Cyclopenta[A]Phenanthren-3-One; Nitric Acid; Hydrochloride; 1-[2-(2,4-Dichlorobenzyl)Oxy-2-(2,4-Dichlorophenyl)Ethyl]Imidazole; (8S,9S,10R,11S,13S,14S,17R)-11,17-Dihydroxy-10,13-Dimethyl-17-[2-(4-Methylpiperazin-1-Yl)Acetyl]-7,8,9,11,12,14,15,16-Octahydro-6H-Cyclopenta[A]Phenanthren-3-One
• Molecular Formula: C₄₄H₅₄Cl₅N₅O₈
• Molecular Weight: 958.20
• CAS Registry Number: 78232-18-5
• SMILES: [N+](O)([O-])=O.[C@]14([C@H]([C@H]3[C@H]([C@@H](O)C1)[C@@]2(C(=CC(=O)C=C2)CC3)C)CC[C@]4(O)C(=O)CN5CCN(CC5)C)C.[H+].C6=CC(=CC(=C6C(OCC7=C(Cl)C=C(Cl)C=C7)C[N]8C=CN=C8)Cl)Cl.[Cl-]
• InChI: 1S/C26H38N2O4.C18H14Cl4N2O.ClH.HNO3/c1-24-8-6-18(29)14-17(24)4-5-19-20-7-9-26(32,25(20,2)15-21(30)23(19)24)22(31)16-28-12-10-27(3)11-13-28;19-13-2-1-12(16(21)7-13)10-25-18(9-24-6-5-23-11-24)15-4-3-14(20)8-17(15)22;;2-1(3)4/h6,8,14,19-21,23,30,32H,4-5,7,9-13,15-16H2,1-3H3;1-8,11,18H,9-10H2;1H;(H,2,3,4)/t19-,20-,21-,23+,24-,25-,26-;;;/m0.../s1
• InChIKey: IHZIQQBUAKZVCI-XTANLHRZSA-N

Properties

• Boiling point: 614°C at 760 mmHg (Cal.)
• Flash point: 325.1°C (Cal.)