3,16-Dihydroxyestra-1,3,5(10)-trien-17-one
[CAS# 966-06-3]

Identification

• Name: 3,16-Dihydroxyestra-1,3,5(10)-trien-17-one
• Synonyms: 16αHo-oe; 16α-Hydroxyestrone; 3,16a-dihydroxy-Estra-1,3,5(10)-trien-17-one
• Molecular Formula: C₁₈H₂₂O₃
• Molecular Weight: 286.37
• CAS Registry Number: 966-06-3
• SMILES: O=C4C3(CCC2c1ccc(O)cc1CCC2C3CC4O)C
• InChI: 1S/C18H22O3/c1-18-7-6-13-12-5-3-11(19)8-10(12)2-4-14(13)15(18)9-16(20)17(18)21/h3,5,8,13-16,19-20H,2,4,6-7,9H2,1H3
• InChIKey: WPOCIZJTELRQMF-UHFFFAOYSA-N

Properties

• Density: 1.25g/cm³ (Cal.)
• Boiling point: 493.175°C at 760 mmHg (Cal.)
• Flash point: 266.162°C (Cal.)