4-(1H-Benzimidazol-4-Yl)-1-Piperazinecarboxylic Acid Ethyl Ester ( Z)-2-Butenedioate (1:1)
[CAS# 84806-83-7]

Identification

• Name: 4-(1H-Benzimidazol-4-Yl)-1-Piperazinecarboxylic Acid Ethyl Ester ( Z)-2-Butenedioate (1:1)
• Synonyms: 4-(1H-Benzimidazol-4-Yl)-1-Piperazinecarboxylic Acid Ethyl Ester; But-2-Enedioic Acid; 4-(1H-Benzimidazol-4-Yl)Piperazine-1-Carboxylic Acid Ethyl Ester; But-2-Enedioic Acid; 1-Piperazinecarboxylic Acid, 4-(1H-Benzimidazol-4-Yl)-, Ethyl Ester, (Z)-2-Butenedioate (1:1)
• Molecular Formula: C₁₈H₂₂N₄O₆
• Molecular Weight: 390.40
• CAS Registry Number: 84806-83-7
• SMILES: C2=CC=C1[NH]C=NC1=C2N3CCN(CC3)C(OCC)=O.O=C(O)\C=C\C(=O)O
• InChI: 1S/C14H18N4O2.C4H4O4/c1-2-20-14(19)18-8-6-17(7-9-18)12-5-3-4-11-13(12)16-10-15-11;5-3(6)1-2-4(7)8/h3-5,10H,2,6-9H2,1H3,(H,15,16);1-2H,(H,5,6)(H,7,8)/b;2-1+
• InChIKey: HJCNCAGOAZNAQG-WLHGVMLRSA-N

Properties

• Boiling point: 530.8°C at 760 mmHg (Cal.)
• Flash point: 274.8°C (Cal.)