6beta-Fluoro-21-Hydroxypregna-1,4,9(11),16-Tetraene-3,20-Dione 21-Acetate
[CAS# 60864-52-0]

Identification

• Name: 6beta-Fluoro-21-Hydroxypregna-1,4,9(11),16-Tetraene-3,20-Dione 21-Acetate
• Synonyms: [2-[(6R,8S,10R,13S,14S)-6-Fluoro-10,13-Dimethyl-3-Oxo-6,7,8,12,14,15-Hexahydrocyclopenta[A]Phenanthren-17-Yl]-2-Oxo-Ethyl] Acetate; Acetic Acid [2-[(6R,8S,10R,13S,14S)-6-Fluoro-10,13-Dimethyl-3-Oxo-6,7,8,12,14,15-Hexahydrocyclopenta[A]Phenanthren-17-Yl]-2-Oxoethyl] Ester; Acetic Acid [2-[(6R,8S,10R,13S,14S)-6-Fluoro-3-Keto-10,13-Dimethyl-6,7,8,12,14,15-Hexahydrocyclopenta[A]Phenanthren-17-Yl]-2-Keto-Ethyl] Ester
• Molecular Formula: C₂₃H₂₅FO₄
• Molecular Weight: 384.45
• CAS Registry Number: 60864-52-0
• EINECS: 262-490-4
• SMILES: [C@H]12[C@H]4C(=CC[C@@]1(C(=CC2)C(=O)COC(=O)C)C)[C@@]3(C(=CC(=O)C=C3)[C@H](F)C4)C
• InChI: 1S/C23H25FO4/c1-13(25)28-12-21(27)18-5-4-16-15-11-20(24)19-10-14(26)6-8-23(19,3)17(15)7-9-22(16,18)2/h5-8,10,15-16,20H,4,9,11-12H2,1-3H3/t15-,16-,20+,22-,23+/m0/s1
• InChIKey: UHEBHFQTEYMJQV-DUYGSNODSA-N

Properties

• Density: 1.247g/cm³ (Cal.)
• Boiling point: 536.392°C at 760 mmHg (Cal.)
• Flash point: 267.991°C (Cal.)