9,11beta-Dichloro-6beta-Fluoro-17,21-Dihydroxy-16alpha-Methylpregna-1,4-Diene-3,20-Dione 17,21-Di(Acetate)
[CAS# 60864-42-8]

Identification

• Name: 9,11beta-Dichloro-6beta-Fluoro-17,21-Dihydroxy-16alpha-Methylpregna-1,4-Diene-3,20-Dione 17,21-Di(Acetate)
• Synonyms: 4-[(6R,8S,10S,11S,13S,14S,16S)-17-(Carboxymethyl)-9,11-Dichloro-6-Fluoro-15-Hydroxy-10,13,16-Trimethyl-3-Oxo-6,7,8,11,12,14,15,16-Octahydrocyclopenta[A]Phenanthren-17-Yl]-3-Hydroxy-4-Oxo-Butanoic Acid; 4-[(6R,8S,10S,11S,13S,14S,16S)-17-(Carboxymethyl)-9,11-Dichloro-6-Fluoro-15-Hydroxy-3-Keto-10,13,16-Trimethyl-6,7,8,11,12,14,15,16-Octahydrocyclopenta[A]Phenanthren-17-Yl]-3-Hydroxy-4-Keto-Butyric Acid; 9,11Beta-Dichloro-6Beta-Fluoro-17,21-Dihydroxy-16Alpha-Methylpregna-1,4-Diene-3,20-Dione 17,21-Di(Acetate)
• Molecular Formula: C₂₆H₃₁Cl₂FO₈
• Molecular Weight: 561.43
• CAS Registry Number: 60864-42-8
• EINECS: 262-482-0
• SMILES: [C@H]12[C@@](C([C@@H](C1O)C)(C(=O)C(O)CC(=O)O)CC(=O)O)(C[C@H](Cl)C3(Cl)[C@H]2C[C@@H](F)C4=CC(=O)C=C[C@]34C)C
• InChI: 1S/C26H31Cl2FO8/c1-11-21(36)20-14-7-15(29)13-6-12(30)4-5-23(13,2)26(14,28)17(27)9-24(20,3)25(11,10-19(34)35)22(37)16(31)8-18(32)33/h4-6,11,14-17,20-21,31,36H,7-10H2,1-3H3,(H,32,33)(H,34,35)/t11-,14+,15-,16?,17+,20-,21?,23+,24+,25?,26?/m1/s1
• InChIKey: ZCJWDFPYXJJIAQ-VFEOTRHJSA-N

Properties

• Density: 1.494g/cm³ (Cal.)
• Boiling point: 770.043°C at 760 mmHg (Cal.)
• Flash point: 419.507°C (Cal.)