2-Bromo-6beta-Fluoro-17,21-Dihydroxy-16beta-Methylpregna-1,4,9(11)-Triene-3,20-Dione 21-Acetate
[CAS# 60864-76-8]

Identification

• Name: 2-Bromo-6beta-Fluoro-17,21-Dihydroxy-16beta-Methylpregna-1,4,9(11)-Triene-3,20-Dione 21-Acetate
• Synonyms: [2-[(6R,8S,10R,13S,14S,16S,17R)-2-Bromo-6-Fluoro-17-Hydroxy-10,13,16-Trimethyl-3-Oxo-7,8,12,14,15,16-Hexahydro-6H-Cyclopenta[A]Phenanthren-17-Yl]-2-Oxo-Ethyl] Acetate; Acetic Acid [2-[(6R,8S,10R,13S,14S,16S,17R)-2-Bromo-6-Fluoro-17-Hydroxy-10,13,16-Trimethyl-3-Oxo-7,8,12,14,15,16-Hexahydro-6H-Cyclopenta[A]Phenanthren-17-Yl]-2-Oxoethyl] Ester; Acetic Acid [2-[(6R,8S,10R,13S,14S,16S,17R)-2-Bromo-6-Fluoro-17-Hydroxy-3-Keto-10,13,16-Trimethyl-7,8,12,14,15,16-Hexahydro-6H-Cyclopenta[A]Phenanthren-17-Yl]-2-Keto-Ethyl] Ester
• Molecular Formula: C₂₄H₂₈BrFO₅
• Molecular Weight: 495.38
• CAS Registry Number: 60864-76-8
• EINECS: 262-503-3
• SMILES: [C@H]12[C@@]([C@](O)([C@H](C1)C)C(=O)COC(=O)C)(CC=C3[C@H]2C[C@@H](F)C4=CC(=O)C(=C[C@]34C)Br)C
• InChI: 1S/C24H28BrFO5/c1-12-7-16-14-8-19(26)17-9-20(28)18(25)10-22(17,3)15(14)5-6-23(16,4)24(12,30)21(29)11-31-13(2)27/h5,9-10,12,14,16,19,30H,6-8,11H2,1-4H3/t12-,14+,16-,19+,22+,23-,24-/m0/s1
• InChIKey: PSNYSZVUCFWIID-MGQHRJHGSA-N

Properties

• Density: 1.446g/cm³ (Cal.)
• Boiling point: 603.17°C at 760 mmHg (Cal.)
• Flash point: 318.586°C (Cal.)