Diethylenetriaminepentaacetate
[CAS# 7578-43-0]

Identification

• Name: Diethylenetriaminepentaacetate
• Synonyms: Sodium 2-[2-[2-(Bis(Carboxymethyl)Amino)Ethyl-(Carboxymethyl)Amino]Ethyl-(Carboxymethyl)Amino]Ethanoate; Acetic Acid, ((Carboxymethylimino)Bis(Ethylenenitrilo))Tetra-, Sodium Derivative; Diethylenetriamine Pentaacetic Acid, Sodium Salt
• Molecular Formula: C₁₄H₂₂N₃NaO₁₀
• Molecular Weight: 415.33
• CAS Registry Number: 7578-43-0
• SMILES: C(N(CCN(CC(=O)O)CC(=O)O)CC(=O)O)CN(CC([O-])=O)CC(=O)O.[Na+]
• InChI: 1S/C14H23N3O10.Na/c18-10(19)5-15(1-3-16(6-11(20)21)7-12(22)23)2-4-17(8-13(24)25)9-14(26)27;/h1-9H2,(H,18,19)(H,20,21)(H,22,23)(H,24,25)(H,26,27);/q;+1/p-1
• InChIKey: UXIDHQPACNSJJP-UHFFFAOYSA-M

Properties

• Boiling point: 721.1°C at 760 mmHg (Cal.)
• Flash point: 389.9°C (Cal.)