17-Hydroxy-6alpha-(trifluoromethyl)pregn-4-ene-3,20-dione 17-acetate
[CAS# 987-18-8]

Identification

• Name: 17-Hydroxy-6alpha-(trifluoromethyl)pregn-4-ene-3,20-dione 17-acetate
• Synonyms: Acetic Acid [(6S,8R,9S,10R,13S,14S,17R)-17-Acetyl-10,13-Dimethyl-3-Oxo-6-(Trifluoromethyl)-2,6,7,8,9,11,12,14,15,16-Decahydro-1H-Cyclopenta[A]Phenanthren-17-Yl] Ester; Acetic Acid [(6S,8R,9S,10R,13S,14S,17R)-17-Acetyl-3-Keto-10,13-Dimethyl-6-(Trifluorometh
• Molecular Formula: C₂₄H₃₁F₃O₄
• Molecular Weight: 440.50
• CAS Registry Number: 987-18-8
• EINECS: 213-577-0
• SMILES: [C@H]12[C@@]([C@@](OC(C)=O)(C(C)=O)CC1)(CC[C@H]3[C@H]2C[C@H](C(F)(F)F)C4=CC(=O)CC[C@]34C)C
• InChI: 1S/C24H31F3O4/c1-13(28)23(31-14(2)29)10-7-18-16-12-20(24(25,26)27)19-11-15(30)5-8-21(19,3)17(16)6-9-22(18,23)4/h11,16-18,20H,5-10,12H2,1-4H3/t16-,17+,18+,20+,21-,22+,23+/m1/s1
• InChIKey: MXZYUFNILISKBC-WXLIAARGSA-N

Properties

• Density: 1.237g/cm³ (Cal.)
• Boiling point: 491.31°C at 760 mmHg (Cal.)
• Flash point: 241.858°C (Cal.)