(2R,8R,9S,10R,13S,14S,17S)-17-Hydroxy-2,13,17-Trimethyl-1,2,6,7,8,9,10,11,12,14,15,16-Dodecahydrocyclopenta[a]Phenanthren-3-One
[CAS# 1093-99-8]

Identification

• Name: (2R,8R,9S,10R,13S,14S,17S)-17-Hydroxy-2,13,17-Trimethyl-1,2,6,7,8,9,10,11,12,14,15,16-Dodecahydrocyclopenta[a]Phenanthren-3-One
• Synonyms: 2Alpha,17-Dimethyl-19-Nortestosterone; 17Beta-Hydroxy-2Alpha,17-Dimethylestr-4-En-3-One; 19-Nortestosterone, 2.Alpha.,17-Dimethyl-
• Molecular Formula: C₂₀H₃₀O₂
• Molecular Weight: 302.46
• CAS Registry Number: 1093-99-8
• SMILES: [C@H]13[C@H]4[C@](CC[C@@H]1[C@@H]2C(=CC(=O)[C@@H](C2)C)CC3)([C@@](C)(O)CC4)C
• InChI: 1S/C20H30O2/c1-12-10-16-13(11-18(12)21)4-5-15-14(16)6-8-19(2)17(15)7-9-20(19,3)22/h11-12,14-17,22H,4-10H2,1-3H3/t12-,14+,15-,16+,17+,19+,20+/m1/s1
• InChIKey: JQIGNJUHWXILBM-OHLKBTDQSA-N

Properties

• Density: 1.105g/cm³ (Cal.)
• Boiling point: 440.484°C at 760 mmHg (Cal.)
• Flash point: 187.787°C (Cal.)