9beta,11alpha-Epoxy-6beta-Fluoro-16alpha,17,21-Trihydroxypregna-1,4-Diene-3,20-Dione 21-Acetate
[CAS# 60864-48-4]

Identification

• Name: 9beta,11alpha-Epoxy-6beta-Fluoro-16alpha,17,21-Trihydroxypregna-1,4-Diene-3,20-Dione 21-Acetate
• Molecular Formula: C₂₃H₂₇FO₇
• Molecular Weight: 434.46
• CAS Registry Number: 60864-48-4
• EINECS: 262-488-3
• SMILES: [C@@H]25C1(OC1C[C@]3([C@H]2C[C@@H](O)[C@]3(O)C(=O)COC(=O)C)C)[C@@]4(C(=CC(=O)C=C4)[C@H](F)C5)C
• InChI: 1S/C23H27FO7/c1-11(25)30-10-18(28)22(29)17(27)8-13-14-7-16(24)15-6-12(26)4-5-20(15,2)23(14)19(31-23)9-21(13,22)3/h4-6,13-14,16-17,19,27,29H,7-10H2,1-3H3/t13-,14-,16+,17+,19?,20-,21-,22-,23?/m0/s1
• InChIKey: ZXCUGBNTNOOANT-FTKILNHSSA-N

Properties

• Density: 1.421g/cm³ (Cal.)
• Boiling point: 594.353°C at 760 mmHg (Cal.)
• Flash point: 313.254°C (Cal.)