3-beta-Hydroxy-5-alpha-Pregnane-11,20-Dione
[CAS# 600-59-9]

Identification

• Name: 3-beta-Hydroxy-5-alpha-Pregnane-11,20-Dione
• Synonyms: 17-Ethanoyl-3-Hydroxy-10,13-Dimethyl-1,2,3,4,5,6,7,8,9,12,14,15,16,17-Tetradecahydrocyclopenta[A]Phenanthren-11-One; 5.Beta.-Pregnane-11,20-Dione, 3.Beta.-Hydroxy-; Pregnane-11,20-Dione, 3-Hydroxy-, (3.Beta.,5.Beta.)-
• Molecular Formula: C₂₁H₃₂O₃
• Molecular Weight: 332.48
• CAS Registry Number: 600-59-9
• EINECS: 209-996-3
• SMILES: CC34C2C(C1C(C(C(C)=O)CC1)(C)CC2=O)CCC3CC(O)CC4
• InChI: 1S/C21H32O3/c1-12(22)16-6-7-17-15-5-4-13-10-14(23)8-9-20(13,2)19(15)18(24)11-21(16,17)3/h13-17,19,23H,4-11H2,1-3H3
• InChIKey: DUHUCHOQIDJXAT-UHFFFAOYSA-N

Properties

• Density: 1.112g/cm³ (Cal.)
• Boiling point: 468.073°C at 760 mmHg (Cal.)
• Flash point: 250.998°C (Cal.)