(8alpha,9beta,10alpha,14beta,17beta)-17-Hydroxyestra-4,6-Dien-3-One
[CAS# 14531-84-1]

Identification

• Name: (8alpha,9beta,10alpha,14beta,17beta)-17-Hydroxyestra-4,6-Dien-3-One
• Molecular Formula: C₁₈H₂₄O₂
• Molecular Weight: 272.38
• CAS Registry Number: 14531-84-1
• SMILES: C[C@]12CC[C@H]3[C@@H]4CCC(=O)C=C4C=C[C@@H]3[C@H]1CC[C@@H]2O
• InChI: 1S/C18H24O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h2,4,10,13-17,20H,3,5-9H2,1H3/t13-,14+,15+,16-,17+,18+/m1/s1
• InChIKey: HFLHHQWDPZNOPI-YLALRLGGSA-N

Properties

• Density: 1.2±0.1g/cm³ (Cal.)
• Boiling point: 453.8±45.0°C at 760 mmHg (Cal.)
• Flash point: 193.3±21.3°C (Cal.)
• Refractive index: 1.584 (Cal.)