N,N'-Bis(2-hydroxybenzyl)ethylenediamine-N,N'-diacetic acid
[CAS# 35998-29-9]

Identification

• Name: N,N'-Bis(2-hydroxybenzyl)ethylenediamine-N,N'-diacetic acid
• Synonyms: 2-[2-[Carboxymethyl-(2-Hydroxybenzyl)Amino]Ethyl-(2-Hydroxybenzyl)Amino]Acetic Acid; 2-[2-[Carboxymethyl-[(2-Hydroxyphenyl)Methyl]Amino]Ethyl-[(2-Hydroxyphenyl)Methyl]Amino]Ethanoic Acid; Brn 3040730
• Molecular Formula: C₂₀H₂₄N₂O₆
• Molecular Weight: 388.42
• CAS Registry Number: 35998-29-9
• SMILES: C1=C(C(=CC=C1)CN(CCN(CC2=CC=CC=C2O)CC(=O)O)CC(=O)O)O
• InChI: 1S/C20H24N2O6/c23-17-7-3-1-5-15(17)11-21(13-19(25)26)9-10-22(14-20(27)28)12-16-6-2-4-8-18(16)24/h1-8,23-24H,9-14H2,(H,25,26)(H,27,28)
• InChIKey: GRUVVLWKPGIYEG-UHFFFAOYSA-N

Properties

• Density: 1.374g/cm³ (Cal.)
• Boiling point: 614.705°C at 760 mmHg (Cal.)
• Flash point: 325.562°C (Cal.)

References

• (1): Santiago Herrero and Miguel A. Usón. Stereochemical nomenclature for octahedral coordination compounds containing polydentate ligands: a comprehensive proposal, Dalton Trans., 2008, 4993.