3b-Hydroxy-6a,16a-dimethylpregn-4-en-20-one
[CAS# 21208-26-4]

Identification

• Name: 3b-Hydroxy-6a,16a-dimethylpregn-4-en-20-one
• Synonyms: 3Beta-Hydroxy-6Alpha,16Alpha-Di-Methylpregn-4-En-20-One.; Dimepregnen; Dimepregnen [Inn:Ban]
• Molecular Formula: C₂₃H₃₆O₂
• Molecular Weight: 344.54
• CAS Registry Number: 21208-26-4
• SMILES: [C@@H]1(CC[C@]3(C(=C1)[C@H](C[C@H]4[C@@H]2C[C@H]([C@H](C(C)=O)[C@@]2(C)CC[C@H]34)C)C)C)O
• InChI: 1S/C23H36O2/c1-13-10-17-18(22(4)8-6-16(25)12-19(13)22)7-9-23(5)20(17)11-14(2)21(23)15(3)24/h12-14,16-18,20-21,25H,6-11H2,1-5H3/t13-,14+,16-,17+,18-,20-,21+,22+,23-/m0/s1
• InChIKey: ATEJLEVEJWUXMA-XGYZZIOMSA-N

Properties

• Density: 1.065g/cm³ (Cal.)
• Boiling point: 458.782°C at 760 mmHg (Cal.)
• Flash point: 195.3°C (Cal.)