(6a,17b)-17-(Acetyloxy)-6-(trifluoromethyl)-Androst-4-en-3-one
[CAS# 2386-05-2]

Identification

• Name: (6a,17b)-17-(Acetyloxy)-6-(trifluoromethyl)-Androst-4-en-3-one
• Synonyms: Acetic Acid [(6S,8R,9S,10R,13S,14S,17S)-10,13-Dimethyl-3-Oxo-6-(Trifluoromethyl)-1,2,6,7,8,9,11,12,14,15,16,17-Dodecahydrocyclopenta[A]Phenanthren-17-Yl] Ester; Acetic Acid [(6S,8R,9S,10R,13S,14S,17S)-3-Keto-10,13-Dimethyl-6-(Trifluoromethyl)-1,2,6,7,8,9,11,12,14,15,16,17-Dodecahydrocyclopenta[A]Phenanthren-17-Yl] Ester; [(6S,8R,9S,10R,13S,14S,17S)-10,13-Dimethyl-3-Oxo-6-(Trifluoromethyl)-1,2,6,7,8,9,11,12,14,15,16,17-Dodecahydrocyclopenta[A]Phenanthren-17-Yl] Ethanoate
• Molecular Formula: C₂₂H₂₉F₃O₃
• Molecular Weight: 398.46
• CAS Registry Number: 2386-05-2
• SMILES: [C@H]1(OC(C)=O)CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2C[C@@H](C4=CC(CC[C@]34C)=O)C(F)(F)F)C
• InChI: 1S/C22H29F3O3/c1-12(26)28-19-5-4-15-14-11-18(22(23,24)25)17-10-13(27)6-8-20(17,2)16(14)7-9-21(15,19)3/h10,14-16,18-19H,4-9,11H2,1-3H3/t14-,15-,16-,18-,19-,20+,21-/m0/s1
• InChIKey: UJAUIJIBACQMCG-CWFJNAJYSA-N

Properties

• Density: 1.218g/cm³ (Cal.)
• Boiling point: 443.841°C at 760 mmHg (Cal.)
• Flash point: 214.34°C (Cal.)