Travocort
[CAS# 78940-01-9]

Identification

• Name: Travocort
• Synonyms: 1-[2-(2,4-Dichlorophenyl)-2-[(2,6-Dichlorophenyl)Methoxy]Ethyl]Imidazole; [2-[(6S,8S,10S,11S,13S,14S,16R,17S)-6,9-Difluoro-11-Hydroxy-10,13,16-Trimethyl-3-Oxo-7,8,11,12,14,15,16,17-Octahydro-6H-Cyclopenta[A]Phenanthren-17-Yl]-2-Oxo-Ethyl] Pentanoate; Nitric Acid; 1-[2-(2,4-Dichlorophenyl)-2-[(2,6-Dichlorophenyl)Methoxy]Ethyl]Imidazole; Nitric Acid; Pentanoic Acid [2-[(6S,8S,10S,11S,13S,14S,16R,17S)-6,9-Difluoro-11-Hydroxy-10,13,16-Trimethyl-3-Oxo-7,8,11,12,14,15,16,17-Octahydro-6H-Cyclopenta[A]Phenanthren-17-Yl]-2-Oxoethyl] Ester
• Molecular Formula: C₄₅H₅₁Cl₄F₂N₃O₉
• Molecular Weight: 957.72
• CAS Registry Number: 78940-01-9
• SMILES: [C@H]23C(F)([C@@]1(C(=CC(=O)C=C1)[C@@H](F)C2)C)[C@@H](O)C[C@]4([C@H]3C[C@H]([C@@H]4C(=O)COC(=O)CCCC)C)C.C7=C(C(OCC5=C(Cl)C=CC=C5Cl)C[N]6C=NC=C6)C(=CC(=C7)Cl)Cl.O=[N+]([O-])O
• InChI: 1S/C27H36F2O5.C18H14Cl4N2O.HNO3/c1-5-6-7-23(33)34-14-21(31)24-15(2)10-17-18-12-20(28)19-11-16(30)8-9-26(19,4)27(18,29)22(32)13-25(17,24)3;19-12-4-5-13(17(22)8-12)18(9-24-7-6-23-11-24)25-10-14-15(20)2-1-3-16(14)21;2-1(3)4/h8-9,11,15,17-18,20,22,24,32H,5-7,10,12-14H2,1-4H3;1-8,11,18H,9-10H2;(H,2,3,4)/t15-,17+,18+,20+,22+,24-,25+,26+,27?;;/m1../s1
• InChIKey: UPINRYVXYNYCOF-UESYANRNSA-N

Properties

• Boiling point: 578.5°C at 760 mmHg (Cal.)
• Flash point: 303.7°C (Cal.)