Antrafenine
[CAS# 55300-29-3]

Identification

• Name: Antrafenine
• Synonyms: 2-[4-[3-(Trifluoromethyl)Phenyl]Piperazin-1-Yl]Ethyl 2-[[7-(Trifluoromethyl)-4-Quinolyl]Amino]Benzoate Dihydrochloride; 2-[[7-(Trifluoromethyl)-4-Quinolyl]Amino]Benzoic Acid 2-[4-[3-(Trifluoromethyl)Phenyl]-1-Piperazinyl]Ethyl Ester Dihydrochloride; 2-[[7-(Trifluoromethyl)-4-Quinolyl]Amino]Benzoic Acid 2-[4-[3-(Trifluoromethyl)Phenyl]Piperazin-1-Yl]Ethyl Ester Dihydrochloride
• Molecular Formula: C₃₀H₂₈Cl₂F₆N₄O₂
• Molecular Weight: 661.47
• CAS Registry Number: 55300-29-3
• SMILES: [H+].[H+].C(N2CCN(C1=CC=CC(=C1)C(F)(F)F)CC2)COC(=O)C3=CC=CC=C3NC4=C5C(=NC=C4)C=C(C(F)(F)F)C=C5.[Cl-].[Cl-]
• InChI: 1S/C30H26F6N4O2.2ClH/c31-29(32,33)20-4-3-5-22(18-20)40-14-12-39(13-15-40)16-17-42-28(41)24-6-1-2-7-25(24)38-26-10-11-37-27-19-21(30(34,35)36)8-9-23(26)27;;/h1-11,18-19H,12-17H2,(H,37,38);2*1H
• InChIKey: GEZLWXYIFNEJBC-UHFFFAOYSA-N

Properties

• Boiling point: 648°C at 760 mmHg (Cal.)
• Flash point: 345.7°C (Cal.)