2-{4-[4-(Trifluoromethyl)phenyl]-1-piperazinyl}ethyl 2-{[7-(trifluoromethyl)-4-quinolinyl]amino}benzoate
[CAS# 85702-69-8]

Identification

• Name: 2-{4-[4-(Trifluoromethyl)phenyl]-1-piperazinyl}ethyl 2-{[7-(trifluoromethyl)-4-quinolinyl]amino}benzoate
• Synonyms: 2-[4-(α,α,α-trifluoro-p-tolyl)-1-piperazinyl]ethyl o-[[7-(trifluoromethyl)-4-quinolyl]amino]benzoate
• Molecular Formula: C₃₀H₂₆F₆N₄O₂
• Molecular Weight: 588.54
• CAS Registry Number: 85702-69-8
• EINECS: 288-259-8
• SMILES: FC(F)(F)c1ccc5c(c1)nccc5Nc2ccccc2C(=O)OCCN3CCN(CC3)c4ccc(cc4)C(F)(F)F
• InChI: 1S/C30H26F6N4O2/c31-29(32,33)20-5-8-22(9-6-20)40-15-13-39(14-16-40)17-18-42-28(41)24-3-1-2-4-25(24)38-26-11-12-37-27-19-21(30(34,35)36)7-10-23(26)27/h1-12,19H,13-18H2,(H,37,38)
• InChIKey: WRYWRWYLEHDHGS-UHFFFAOYSA-N

Properties

• Density: 1.359g/cm³ (Cal.)
• Boiling point: 650.051°C at 760 mmHg (Cal.)
• Flash point: 346.939°C (Cal.)