4-Androsten-16alpha-Ol-3,17-Dione
[CAS# 63-02-5]

Identification

• Name: 4-Androsten-16alpha-Ol-3,17-Dione
• Synonyms: (8R,9S,10R,13S,14S,16R)-16-Hydroxy-10,13-Dimethyl-2,6,7,8,9,11,12,14,15,16-Decahydro-1H-Cyclopenta[A]Phenanthrene-3,17-Quinone; 4-Androsten-16Alpha-Ol-3,17-Dione; C05140
• Molecular Formula: C₁₉H₂₆O₃
• Molecular Weight: 302.41
• CAS Registry Number: 63-02-5
• SMILES: [C@@]34(C)[C@@H]1[C@H]([C@H]2[C@@](CC1)(C)C([C@@H](C2)O)=O)CCC3=CC(CC4)=O
• InChI: 1S/C19H26O3/c1-18-7-5-12(20)9-11(18)3-4-13-14(18)6-8-19(2)15(13)10-16(21)17(19)22/h9,13-16,21H,3-8,10H2,1-2H3/t13-,14+,15+,16-,18+,19+/m1/s1
• InChIKey: SSBCZTXGVMMZOT-NBBHSKLNSA-N

Properties

• Density: 1.191g/cm³ (Cal.)
• Boiling point: 475.33°C at 760 mmHg (Cal.)
• Flash point: 255.382°C (Cal.)