6-Dehydrodeoxycorticosterone Acetate
[CAS# 21589-90-2]

Identification

• Name: 6-Dehydrodeoxycorticosterone Acetate
• Synonyms: [2-[(8S,9S,10R,13S,14S,17S)-10,13-Dimethyl-3-Oxo-1,2,8,9,11,12,14,15,16,17-Decahydrocyclopenta[A]Phenanthren-17-Yl]-2-Oxo-Ethyl] Acetate; Acetic Acid [2-[(8S,9S,10R,13S,14S,17S)-10,13-Dimethyl-3-Oxo-1,2,8,9,11,12,14,15,16,17-Decahydrocyclopenta[A]Phenanthren-17-Yl]-2-Oxoethyl] Ester; Acetic Acid [2-Keto-2-[(8S,9S,10R,13S,14S,17S)-3-Keto-10,13-Dimethyl-1,2,8,9,11,12,14,15,16,17-Decahydrocyclopenta[A]Phenanthren-17-Yl]Ethyl] Ester
• Molecular Formula: C₂₃H₃₀O₄
• Molecular Weight: 370.49
• CAS Registry Number: 21589-90-2
• SMILES: [C@H]24[C@H]1[C@@]([C@H](CC1)C(=O)COC(=O)C)(CC[C@@H]2[C@@]3(C(=CC(=O)CC3)C=C4)C)C
• InChI: 1S/C23H30O4/c1-14(24)27-13-21(26)20-7-6-18-17-5-4-15-12-16(25)8-10-22(15,2)19(17)9-11-23(18,20)3/h4-5,12,17-20H,6-11,13H2,1-3H3/t17-,18-,19-,20+,22-,23-/m0/s1
• InChIKey: NHIPOYQWSUQCGL-ACXQXYJUSA-N

Properties

• Density: 1.167g/cm³ (Cal.)
• Boiling point: 519.174°C at 760 mmHg (Cal.)
• Flash point: 225.263°C (Cal.)