[(8R,9S,10R,13S,14S,17S)-10,13-Dimethyl-3-Oxo-1,2,6,7,8,9,11,12,14,15,16,17-Dodecahydrocyclopenta[a]Phenanthren-17-Yl] Butanoate
[CAS# 3410-54-6]

Identification

• Name: [(8R,9S,10R,13S,14S,17S)-10,13-Dimethyl-3-Oxo-1,2,6,7,8,9,11,12,14,15,16,17-Dodecahydrocyclopenta[a]Phenanthren-17-Yl] Butanoate
• Synonyms: Butanoic Acid [(8R,9S,10R,13S,14S,17S)-10,13-Dimethyl-3-Oxo-1,2,6,7,8,9,11,12,14,15,16,17-Dodecahydrocyclopenta[A]Phenanthren-17-Yl] Ester; Butyric Acid [(8R,9S,10R,13S,14S,17S)-3-Keto-10,13-Dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-Dodecahydrocyclopenta[A]Phenanthren-17-Yl] Ester; 17Beta-Hydroxyandrost-4-Ene-3-One Butyrate
• Molecular Formula: C₂₃H₃₄O₃
• Molecular Weight: 358.52
• CAS Registry Number: 3410-54-6
• EINECS: 222-296-2
• SMILES: [C@H]24[C@H]1[C@@]([C@@H](OC(=O)CCC)CC1)(CC[C@@H]2[C@@]3(C(=CC(=O)CC3)CC4)C)C
• InChI: 1S/C23H34O3/c1-4-5-21(25)26-20-9-8-18-17-7-6-15-14-16(24)10-12-22(15,2)19(17)11-13-23(18,20)3/h14,17-20H,4-13H2,1-3H3/t17-,18-,19-,20-,22-,23-/m0/s1
• InChIKey: OMPTUWYLCDEFSJ-WAUHAFJUSA-N

Properties

• Density: 1.095g/cm³ (Cal.)
• Boiling point: 467.147°C at 760 mmHg (Cal.)
• Flash point: 200.954°C (Cal.)