3,21-Dihydroxypregnan-20-One
[CAS# 567-01-1]

Identification

• Name: 3,21-Dihydroxypregnan-20-One
• Synonyms: 3Î’,21-DIHYDROXY-5Α-PREGNAN-20-ONE; NSC113927
• Molecular Formula: C₂₁H₃₄O₃
• Molecular Weight: 334.49
• CAS Registry Number: 567-01-1
• SMILES: O=C(CO)C2C1(CCC3C(C1CC2)CCC4C3(CCC(O)C4)C)C
• InChI: 1S/C21H34O3/c1-20-9-7-14(23)11-13(20)3-4-15-16-5-6-18(19(24)12-22)21(16,2)10-8-17(15)20/h13-18,22-23H,3-12H2,1-2H3
• InChIKey: CYKYBWRSLLXBOW-UHFFFAOYSA-N

Properties

• Density: 1.115g/cm³ (Cal.)
• Boiling point: 470.257°C at 760 mmHg (Cal.)
• Flash point: 252.317°C (Cal.)