6-Dehydrofluorocortisol Acetate
[CAS# 564-57-8]

Identification

• Name: 6-Dehydrofluorocortisol Acetate
• Synonyms: [2-[(8S,10S,11S,13S,14S,17R)-9-Fluoro-11,17-Dihydroxy-10,13-Dimethyl-3-Oxo-1,2,8,11,12,14,15,16-Octahydrocyclopenta[A]Phenanthren-17-Yl]-2-Oxo-Ethyl] Acetate; Acetic Acid [2-[(8S,10S,11S,13S,14S,17R)-9-Fluoro-11,17-Dihydroxy-10,13-Dimethyl-3-Oxo-1,2,8,11,12,14,15,16-Octahydrocyclopenta[A]Phenanthren-17-Yl]-2-Oxoethyl] Ester; Acetic Acid [2-[(8S,10S,11S,13S,14S,17R)-9-Fluoro-11,17-Dihydroxy-3-Keto-10,13-Dimethyl-1,2,8,11,12,14,15,16-Octahydrocyclopenta[A]Phenanthren-17-Yl]-2-Keto-Ethyl] Ester
• Molecular Formula: C₂₃H₂₉FO₆
• Molecular Weight: 420.48
• CAS Registry Number: 564-57-8
• SMILES: [C@H]34[C@H]2C(F)([C@@]1(C(=CC(=O)CC1)C=C2)C)[C@@H](O)C[C@@]3([C@](O)(CC4)C(=O)COC(=O)C)C
• InChI: 1S/C23H29FO6/c1-13(25)30-12-19(28)22(29)9-7-16-17-5-4-14-10-15(26)6-8-20(14,2)23(17,24)18(27)11-21(16,22)3/h4-5,10,16-18,27,29H,6-9,11-12H2,1-3H3/t16-,17-,18-,20-,21-,22-,23?/m0/s1
• InChIKey: GSRCJMSHBYRGBV-FHKFZDDKSA-N

Properties

• Density: 1.325g/cm³ (Cal.)
• Boiling point: 590.184°C at 760 mmHg (Cal.)
• Flash point: 310.732°C (Cal.)