9-Fluoro-11beta,17-Dihydroxy-16alpha-Methylpregna-1,4-Diene-3,20-Dione 21-[(9E,12E)-Octadeca-9,12-Dienoate]
[CAS# 58769-04-3]

Identification

• Name: 9-Fluoro-11beta,17-Dihydroxy-16alpha-Methylpregna-1,4-Diene-3,20-Dione 21-[(9E,12E)-Octadeca-9,12-Dienoate]
• Synonyms: [2-(9-Fluoro-11,17-Dihydroxy-10,13,16-Trimethyl-3-Oxo-6,7,8,11,12,14,15,16-Octahydrocyclopenta[A]Phenanthren-17-Yl)-2-Oxo-Ethyl] (9Z,12Z)-Octadeca-9,12-Dienoate; (9Z,12Z)-Octadeca-9,12-Dienoic Acid [2-(9-Fluoro-11,17-Dihydroxy-10,13,16-Trimethyl-3-Oxo-6,7,8,11,12,14,15,16-Octahydrocyclopenta[A]Phenanthren-17-Yl)-2-Oxoethyl] Ester; (9Z,12Z)-Octadeca-9,12-Dienoic Acid [2-(9-Fluoro-11,17-Dihydroxy-3-Keto-10,13,16-Trimethyl-6,7,8,11,12,14,15,16-Octahydrocyclopenta[A]Phenanthren-17-Yl)-2-Keto-Ethyl] Ester
• Molecular Formula: C₄₀H₅₉FO₆
• Molecular Weight: 654.90
• CAS Registry Number: 58769-04-3
• EINECS: 261-432-5
• SMILES: C(OC(=O)CCCCCCC\C=C/C/C=C\CCCCC)C(=O)C4(O)C3(C(C2C(F)(C1(C(=CC(=O)C=C1)CC2)C)C(O)C3)CC4C)C
• InChI: 1S/C40H59FO6/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-36(45)47-28-35(44)40(46)29(2)25-33-32-22-21-30-26-31(42)23-24-37(30,3)39(32,41)34(43)27-38(33,40)4/h9-10,12-13,23-24,26,29,32-34,43,46H,5-8,11,14-22,25,27-28H2,1-4H3/b10-9-,13-12-
• InChIKey: JCTITVWENFVLBV-UTJQPWESSA-N

Properties

• Density: 1.134g/cm³ (Cal.)
• Boiling point: 736.69°C at 760 mmHg (Cal.)
• Flash point: 399.336°C (Cal.)