(7R,8R,9S,10R,13S,14S,17R)-17-Hydroxy-17-[(E)-2-Iodoethenyl]-7,13-Dimethyl-1,2,6,7,8,9,10,11,12,14,15,16-Dodecahydrocyclopenta[a]Phenanthren-3-One
[CAS# 131545-89-6]

Identification

• Name: (7R,8R,9S,10R,13S,14S,17R)-17-Hydroxy-17-[(E)-2-Iodoethenyl]-7,13-Dimethyl-1,2,6,7,8,9,10,11,12,14,15,16-Dodecahydrocyclopenta[a]Phenanthren-3-One
• Synonyms: (7R,8R,9S,10R,13S,14S,17R)-17-Hydroxy-17-[(E)-2-Iodovinyl]-7,13-Dimethyl-1,2,6,7,8,9,10,11,12,14,15,16-Dodecahydrocyclopenta[A]Phenanthren-3-One; 7Alpha-Methyl-17Alpha-(E-2'-(125I)-Iodovinyl)-19-Nortestosterone; Mivnt
• Molecular Formula: C₂₁H₂₉IO₂
• Molecular Weight: 440.36
• CAS Registry Number: 131545-89-6
• SMILES: [C@H]12CCC(C=C1C[C@H]([C@@H]3[C@@H]2CC[C@]4([C@H]3CC[C@]4(\C=C\I)O)C)C)=O
• InChI: 1S/C21H29IO2/c1-13-11-14-12-15(23)3-4-16(14)17-5-7-20(2)18(19(13)17)6-8-21(20,24)9-10-22/h9-10,12-13,16-19,24H,3-8,11H2,1-2H3/b10-9+/t13-,16+,17-,18+,19-,20+,21-/m1/s1
• InChIKey: ZYZDMAJYGAZXEO-NOWBUFNOSA-N

Properties

• Density: 1.453g/cm³ (Cal.)
• Boiling point: 512.72°C at 760 mmHg (Cal.)
• Flash point: 263.884°C (Cal.)