9-Fluoro-10,13,17-Trimethyl-2,3,4,5,6,7,8,11,12,14,15,16-Dodecahydro-1H-Cyclopenta[a]Phenanthrene-3,11,17-Triol
[CAS# 53649-14-2]

Identification

• Name: 9-Fluoro-10,13,17-Trimethyl-2,3,4,5,6,7,8,11,12,14,15,16-Dodecahydro-1H-Cyclopenta[a]Phenanthrene-3,11,17-Triol
• Synonyms: C14616; Androstane-3,11,17-Triol, 9-Fluoro-17-Methyl-, (3.Alpha.,5.Beta.,11.Beta.,17.Beta.)-; Nsc23596
• Molecular Formula: C₂₀H₃₃FO₃
• Molecular Weight: 340.48
• CAS Registry Number: 53649-14-2
• SMILES: [C@@]1(CC[C@H]2[C@H]3[C@](F)([C@@H](O)C[C@]12C)[C@]4(C)[C@H](CC3)C[C@@H](CC4)O)(C)O
• InChI: 1S/C20H33FO3/c1-17-8-6-13(22)10-12(17)4-5-15-14-7-9-19(3,24)18(14,2)11-16(23)20(15,17)21/h12-16,22-24H,4-11H2,1-3H3/t12-,13-,14+,15+,16+,17+,18+,19+,20+/m1/s1
• InChIKey: XKASGEXHNLDQIB-ZPPBZJDISA-N

Properties

• Density: 1.198g/cm³ (Cal.)
• Boiling point: 458.154°C at 760 mmHg (Cal.)
• Flash point: 230.883°C (Cal.)