20-(Hydroxymethyl)Pregna-1,4-Dien-3-One
[CAS# 35525-27-0]

Identification

• Name: 20-(Hydroxymethyl)Pregna-1,4-Dien-3-One
• Synonyms: (8S,9S,10R,13S,14S,17S)-17-[(1R)-2-Hydroxy-1-Methyl-Ethyl]-10,13-Dimethyl-6,7,8,9,11,12,14,15,16,17-Decahydrocyclopenta[A]Phenanthren-3-One; (8S,9S,10R,13S,14S,17S)-17-[(1R)-2-Hydroxy-1-Methylethyl]-10,13-Dimethyl-6,7,8,9,11,12,14,15,16,17-Decahydrocyclopenta[A]Phenanthren-3-One; Zinc03861509
• Molecular Formula: C₂₂H₃₂O₂
• Molecular Weight: 328.49
• CAS Registry Number: 35525-27-0
• SMILES: [C@H]34[C@H]2[C@@H]([C@@]1(C(=CC(=O)C=C1)CC2)C)CC[C@@]3([C@H]([C@H](CO)C)CC4)C
• InChI: 1S/C22H32O2/c1-14(13-23)18-6-7-19-17-5-4-15-12-16(24)8-10-21(15,2)20(17)9-11-22(18,19)3/h8,10,12,14,17-20,23H,4-7,9,11,13H2,1-3H3/t14-,17-,18-,19-,20-,21-,22+/m0/s1
• InChIKey: FRCNDHZJYALSFS-YBQWHCOOSA-N

Properties

• Density: 1.097g/cm³ (Cal.)
• Boiling point: 465.967°C at 760 mmHg (Cal.)
• Flash point: 198.225°C (Cal.)