2-Bromo-9beta,11beta-Epoxy-6beta-Fluoro-16alpha,17,21-Trihydroxypregna-1,4-Diene-3,20-Dione
[CAS# 60864-70-2]

Identification

• Name: 2-Bromo-9beta,11beta-Epoxy-6beta-Fluoro-16alpha,17,21-Trihydroxypregna-1,4-Diene-3,20-Dione
• Molecular Formula: C₂₁H₂₄BrFO₆
• Molecular Weight: 471.32
• CAS Registry Number: 60864-70-2
• EINECS: 262-499-3
• SMILES: [C@]45(C13OC1C[C@@]2([C@]([C@@H](C[C@H]2[C@@H]3C[C@H](C4=CC(C(=C5)Br)=O)F)O)(C(=O)CO)O)C)C
• InChI: 1S/C21H24BrFO6/c1-18-7-17-21(29-17)10(9(18)5-15(26)20(18,28)16(27)8-24)3-13(23)11-4-14(25)12(22)6-19(11,21)2/h4,6,9-10,13,15,17,24,26,28H,3,5,7-8H2,1-2H3/t9-,10-,13+,15+,17?,18-,19-,20-,21?/m0/s1
• InChIKey: FUBXEJMHWJJGLI-IEILPTMTSA-N

Properties

• Density: 1.678g/cm³ (Cal.)
• Boiling point: 631.093°C at 760 mmHg (Cal.)
• Flash point: 335.473°C (Cal.)