1-(4-Aminobenzyl)Ethylenediamine-N,N,N',N'-Tetraacetic Acid
[CAS# 84256-90-6]

Identification

• Name: 1-(4-Aminobenzyl)Ethylenediamine-N,N,N',N'-Tetraacetic Acid
• Synonyms: 2-[[1-[(4-Aminophenyl)Methyl]-2-(Bis(Carboxymethyl)Amino)Ethyl]-(Carboxymethyl)Amino]Acetic Acid; 2-[[1-(4-Aminobenzyl)-2-(Bis(Carboxymethyl)Amino)Ethyl]-(Carboxymethyl)Amino]Acetic Acid; 2-[[1-(4-Aminophenyl)-3-(Bis(Carboxymethyl)Amino)Propan-2-Yl]-(Carboxymethyl)Amino]Ethanoic Acid
• Molecular Formula: C₁₇H₂₃N₃O₈
• Molecular Weight: 397.38
• CAS Registry Number: 84256-90-6
• SMILES: C1=C(CC(N(CC(O)=O)CC(O)=O)CN(CC(O)=O)CC(O)=O)C=CC(=C1)N
• InChI: 1S/C17H23N3O8/c18-12-3-1-11(2-4-12)5-13(20(9-16(25)26)10-17(27)28)6-19(7-14(21)22)8-15(23)24/h1-4,13H,5-10,18H2,(H,21,22)(H,23,24)(H,25,26)(H,27,28)
• InChIKey: RPBJIOJIMOUOIN-UHFFFAOYSA-N

Properties

• Density: 1.491g/cm³ (Cal.)
• Boiling point: 748.956°C at 760 mmHg (Cal.)
• Flash point: 406.754°C (Cal.)