6alpha,9-Difluoro-11beta-Hydroxy-16alpha,17-[Isopropylidenebis(Oxy)]Pregna-1,4-Diene-3,20-Dione 21-Propionate
[CAS# 58497-00-0]

Identification

• Name: 6alpha,9-Difluoro-11beta-Hydroxy-16alpha,17-[Isopropylidenebis(Oxy)]Pregna-1,4-Diene-3,20-Dione 21-Propionate
• Synonyms: 6Alpha,9-Difluoro-11Beta-Hydroxy-16Alpha,17-(Isopropylidenebis(Oxy))Pregna-1,4-Diene-3,20-Dione 21-Propionate; Procinonide
• Molecular Formula: C₂₇H₃₄F₂O₇
• Molecular Weight: 508.56
• CAS Registry Number: 58497-00-0
• EINECS: 261-289-9
• SMILES: [C@@]23(F)C1(C(=CC(=O)C=C1)[C@@H](F)CC2C5C(CC3O)([C@]4(C(=O)COC(=O)CC)OC(O[C@@H]4C5)(C)C)C)C
• InChI: 1S/C27H34F2O7/c1-6-22(33)34-13-20(32)27-21(35-23(2,3)36-27)11-15-16-10-18(28)17-9-14(30)7-8-24(17,4)26(16,29)19(31)12-25(15,27)5/h7-9,15-16,18-19,21,31H,6,10-13H2,1-5H3/t15?,16?,18-,19?,21+,24?,25?,26-,27+/m0/s1
• InChIKey: UBOIMZIXNXGQOH-KPEZXFROSA-N

Properties

• Density: 1.324g/cm³ (Cal.)
• Boiling point: 600.625°C at 760 mmHg (Cal.)
• Flash point: 317.046°C (Cal.)