9-Chloro-6a-Fluoro-11b-Hydroxy-21-Acetoxy-16a-Methylpregna-1,4-Diene-3,20-Dione
[CAS# 4258-85-9]

Identification

• Name: 9-Chloro-6a-Fluoro-11b-Hydroxy-21-Acetoxy-16a-Methylpregna-1,4-Diene-3,20-Dione
• Synonyms: [2-[(6S,8S,10S,11S,13S,14S,16R,17S)-9-Chloro-6-Fluoro-11-Hydroxy-10,13,16-Trimethyl-3-Oxo-7,8,11,12,14,15,16,17-Octahydro-6H-Cyclopenta[A]Phenanthren-17-Yl]-2-Oxo-Ethyl] Acetate; Acetic Acid [2-[(6S,8S,10S,11S,13S,14S,16R,17S)-9-Chloro-6-Fluoro-11-Hydroxy-10,13,16-Trimethyl-3-Oxo-7,8,11,12,14,15,16,17-Octahydro-6H-Cyclopenta[A]Phenanthren-17-Yl]-2-Oxoethyl] Ester; Acetic Acid [2-[(6S,8S,10S,11S,13S,14S,16R,17S)-9-Chloro-6-Fluoro-11-Hydroxy-3-Keto-10,13,16-Trimethyl-7,8,11,12,14,15,16,17-Octahydro-6H-Cyclopenta[A]Phenanthren-17-Yl]-2-Keto-Ethyl] Ester
• Molecular Formula: C₂₄H₃₀ClFO₅
• Molecular Weight: 452.95
• CAS Registry Number: 4258-85-9
• SMILES: [C@H]2(C1=CC(C=C[C@@]1(C4([C@@H](C2)[C@@H]3C[C@H]([C@H](C(COC(=O)C)=O)[C@@]3(C)C[C@@H]4O)C)Cl)C)=O)F
• InChI: 1S/C24H30ClFO5/c1-12-7-15-16-9-18(26)17-8-14(28)5-6-23(17,4)24(16,25)20(30)10-22(15,3)21(12)19(29)11-31-13(2)27/h5-6,8,12,15-16,18,20-21,30H,7,9-11H2,1-4H3/t12-,15+,16+,18+,20+,21-,22+,23+,24?/m1/s1
• InChIKey: ARPLCFGLEYFDCN-JIAFSOTFSA-N

Properties

• Density: 1.298g/cm³ (Cal.)
• Boiling point: 577.995°C at 760 mmHg (Cal.)
• Flash point: 303.361°C (Cal.)