11alpha-Hydroxyandrosta-1,4-Diene-3,17-Dione
[CAS# 7801-18-5]

Identification

• Name: 11alpha-Hydroxyandrosta-1,4-Diene-3,17-Dione
• Synonyms: (8S,9S,10R,11R,13S,14S)-11-Hydroxy-10,13-Dimethyl-7,8,9,11,12,14,15,16-Octahydro-6H-Cyclopenta[A]Phenanthrene-3,17-Quinone; C14587; 11-Hydroxy-1,4-Androstadiene-3,17-Dione
• Molecular Formula: C₁₉H₂₄O₃
• Molecular Weight: 300.40
• CAS Registry Number: 7801-18-5
• EINECS: 232-256-6
• SMILES: [C@]34([C@@H]2[C@H]([C@@H]1CCC([C@]1(C[C@H]2O)C)=O)CCC3=CC(C=C4)=O)C
• InChI: 1S/C19H24O3/c1-18-8-7-12(20)9-11(18)3-4-13-14-5-6-16(22)19(14,2)10-15(21)17(13)18/h7-9,13-15,17,21H,3-6,10H2,1-2H3/t13-,14-,15+,17+,18-,19-/m0/s1
• InChIKey: ZHOLUHXKCIXGSR-GBHAUCNQSA-N

Properties

• Density: 1.215g/cm³ (Cal.)
• Boiling point: 479.027°C at 760 mmHg (Cal.)
• Flash point: 257.616°C (Cal.)