(3alpha,5alpha,16alpha)-16-Bromo-3-Hydroxyandrostan-17-One
[CAS# 60802-13-3]

Identification

• Name: (3alpha,5alpha,16alpha)-16-Bromo-3-Hydroxyandrostan-17-One
• Synonyms: 16A-BROMOANDROSTERONE
• Molecular Formula: C₁₉H₂₉BrO₂
• Molecular Weight: 369.34
• CAS Registry Number: 60802-13-3
• SMILES: C[C@]12CC[C@H](C[C@@H]1CC[C@@H]3[C@@H]2CC[C@]4([C@H]3C[C@H](C4=O)Br)C)O
• InChI: 1S/C19H29BrO2/c1-18-7-5-12(21)9-11(18)3-4-13-14(18)6-8-19(2)15(13)10-16(20)17(19)22/h11-16,21H,3-10H2,1-2H3/t11-,12+,13+,14-,15-,16+,18-,19-/m0/s1
• InChIKey: CWVMWSZEMZOUPC-LLIWRYSGSA-N

Properties

• Density: 1.31g/cm³ (Cal.)
• Boiling point: 448.561°C at 760 mmHg (Cal.)
• Flash point: 225.082°C (Cal.)