(5alpha,17beta)-17-Hydroxyandrostane-3,7-Dione
[CAS# 55541-91-8]

Identification

• Name: (5alpha,17beta)-17-Hydroxyandrostane-3,7-Dione
• Synonyms: 5α-Androstan-17β-ol-3,7-dione
• Molecular Formula: C₁₉H₂₈O₃
• Molecular Weight: 304.42
• CAS Registry Number: 55541-91-8
• SMILES: C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2O)C(=O)C[C@@H]4[C@@]3(CCC(=O)C4)C
• InChI: 1S/C19H28O3/c1-18-7-5-12(20)9-11(18)10-15(21)17-13-3-4-16(22)19(13,2)8-6-14(17)18/h11,13-14,16-17,22H,3-10H2,1-2H3/t11-,13+,14+,16+,17+,18+,19+/m1/s1
• InChIKey: QXFYDCQIFPOPPV-LMYJXFHDSA-N

Properties

• Density: 1.2±0.1g/cm³ (Cal.)
• Boiling point: 453.4±45.0°C at 760 mmHg (Cal.)
• Flash point: 242.1±25.2°C (Cal.)