14-Hydroxypregna-1,4-Diene-3,20-Dione
[CAS# 97055-11-3]

Identification

• Name: 14-Hydroxypregna-1,4-Diene-3,20-Dione
• Synonyms: (8R,9S,10R,13R,14R,17S)-17-Ethanoyl-14-Hydroxy-10,13-Dimethyl-7,8,9,11,12,15,16,17-Octahydro-6H-Cyclopenta[A]Phenanthren-3-One; 14-Oh-Pdd; Pregna, 1,4-Diene-3,20-Dione, 14-Hydroxy-
• Molecular Formula: C₂₁H₂₈O₃
• Molecular Weight: 328.45
• CAS Registry Number: 97055-11-3
• SMILES: [C@H]24[C@@]1(O)[C@@]([C@H](CC1)C(=O)C)(CC[C@@H]2[C@@]3(C(=CC(=O)C=C3)CC4)C)C
• InChI: 1S/C21H28O3/c1-13(22)16-8-11-21(24)18-5-4-14-12-15(23)6-9-19(14,2)17(18)7-10-20(16,21)3/h6,9,12,16-18,24H,4-5,7-8,10-11H2,1-3H3/t16-,17+,18-,19+,20-,21-/m1/s1
• InChIKey: NEJRQZFTRAYLHK-JRBOJVLQSA-N

Properties

• Density: 1.175g/cm³ (Cal.)
• Boiling point: 483.91°C at 760 mmHg (Cal.)
• Flash point: 260.566°C (Cal.)