4-(2-(4-(4-Fluorophenyl)-1-Piperazinyl)Ethyl)-1-Piperazinecarboxylic Acid Phenylmethyl Ester (E)-2-Butenedioate (1:2)
[CAS# 65274-81-9]

Identification

• Name: 4-(2-(4-(4-Fluorophenyl)-1-Piperazinyl)Ethyl)-1-Piperazinecarboxylic Acid Phenylmethyl Ester (E)-2-Butenedioate (1:2)
• Synonyms: But-2-Enedioic Acid; 4-[2-[4-(4-Fluorophenyl)-1-Piperazinyl]Ethyl]-1-Piperazinecarboxylic Acid Phenylmethyl Ester; But-2-Enedioic Acid; 4-[2-[4-(4-Fluorophenyl)Piperazin-1-Yl]Ethyl]Piperazine-1-Carboxylic Acid Benzyl Ester; 1-Piperazinecarboxylic Acid, 4-(2-(4-(4-Fluorophenyl)-1-Piperazinyl)Ethyl)-, Phenylmethyl Ester, (E)-2-Butenedioate (1:2)
• Molecular Formula: C₃₂H₃₉FN₄O₁₀
• Molecular Weight: 658.68
• CAS Registry Number: 65274-81-9
• SMILES: C4=C(N1CCN(CC1)CCN3CCN(C(OCC2=CC=CC=C2)=O)CC3)C=CC(=C4)F.O=C(O)\C=C\C(=O)O.O=C(O)\C=C\C(=O)O
• InChI: 1S/C24H31FN4O2.2C4H4O4/c25-22-6-8-23(9-7-22)28-16-12-26(13-17-28)10-11-27-14-18-29(19-15-27)24(30)31-20-21-4-2-1-3-5-21;2*5-3(6)1-2-4(7)8/h1-9H,10-20H2;2*1-2H,(H,5,6)(H,7,8)/b;2*2-1+
• InChIKey: HRAZRRGPIQBOOO-LVEZLNDCSA-N

Properties

• Boiling point: 555.5°C at 760 mmHg (Cal.)
• Flash point: 289.7°C (Cal.)