(8S,9S,10R,13S,14S,17S)-10,13-Dimethyl-17-(2-Phenylselanylacetyl)-1,2,6,7,8,9,11,12,14,15,16,17-Dodecahydrocyclopenta[a]Phenanthren-3-One
[CAS# 74136-99-5]

Identification

• Name: (8S,9S,10R,13S,14S,17S)-10,13-Dimethyl-17-(2-Phenylselanylacetyl)-1,2,6,7,8,9,11,12,14,15,16,17-Dodecahydrocyclopenta[a]Phenanthren-3-One
• Synonyms: (8S,9S,10R,13S,14S,17S)-10,13-Dimethyl-17-[1-Oxo-2-(Phenylseleno)Ethyl]-1,2,6,7,8,9,11,12,14,15,16,17-Dodecahydrocyclopenta[A]Phenanthren-3-One; (8S,9S,10R,13S,14S,17S)-10,13-Dimethyl-17-[2-(Phenylseleno)Acetyl]-1,2,6,7,8,9,11,12,14,15,16,17-Dodecahydrocyclopenta[A]Phenanthren-3-One; (8S,9S,10R,13S,14S,17S)-10,13-Dimethyl-17-(2-Phenylselanylethanoyl)-1,2,6,7,8,9,11,12,14,15,16,17-Dodecahydrocyclopenta[A]Phenanthren-3-One
• Molecular Formula: C₂₇H₃₄O₂Se
• Molecular Weight: 469.52
• CAS Registry Number: 74136-99-5
• SMILES: [C@H]35[C@H]1[C@@]([C@H](CC1)C(=O)C[Se]C2=CC=CC=C2)(CC[C@@H]3[C@@]4(C(=CC(=O)CC4)CC5)C)C
• InChI: 1S/C27H34O2Se/c1-26-14-12-19(28)16-18(26)8-9-21-22-10-11-24(27(22,2)15-13-23(21)26)25(29)17-30-20-6-4-3-5-7-20/h3-7,16,21-24H,8-15,17H2,1-2H3/t21-,22-,23-,24+,26-,27-/m0/s1
• InChIKey: PGPLULVIABTRIF-YNHSGCSHSA-N

Properties

• Boiling point: 575.338°C at 760 mmHg (Cal.)
• Flash point: 301.754°C (Cal.)