4-Pregnen-7alpha-Ol-3,20-Dione
[CAS# 27534-93-6]

Identification

• Name: 4-Pregnen-7alpha-Ol-3,20-Dione
• Synonyms: (8S,9S,10R,13S,14S,17S)-17-Ethanoyl-7-Hydroxy-10,13-Dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-Dodecahydrocyclopenta[A]Phenanthren-3-One; 7-Hydroxyprogesterone; 7Alpha-Hydroxyprogesterone
• Molecular Formula: C₂₁H₃₀O₃
• Molecular Weight: 330.47
• CAS Registry Number: 27534-93-6
• SMILES: [C@@H]23C(CC1=CC(CC[C@@]1([C@H]2CC[C@]4([C@H]3CC[C@@H]4C(=O)C)C)C)=O)O
• InChI: 1S/C21H30O3/c1-12(22)15-4-5-16-19-17(7-9-21(15,16)3)20(2)8-6-14(23)10-13(20)11-18(19)24/h10,15-19,24H,4-9,11H2,1-3H3/t15-,16+,17+,18?,19+,20+,21-/m1/s1
• InChIKey: QRDYCDIUGUAUBZ-CWNZLVRBSA-N

Properties

• Density: 1.152g/cm³ (Cal.)
• Boiling point: 489.056°C at 760 mmHg (Cal.)
• Flash point: 263.674°C (Cal.)