Diethylenetriamine-pentaacetic acid copper(II) trisodium salt hemihydrate
[CAS# 12189-76-3]

Identification

• Name: Diethylenetriamine-pentaacetic acid copper(II) trisodium salt hemihydrate
• Synonyms: Copper Trisodium 2-[Bis[2-[Bis(2-Oxido-2-Oxo-Ethyl)Amino]Ethyl]Amino]Acetate; Cupric Trisodium 2-[Bis[2-[Bis(2-Keto-2-Oxido-Ethyl)Amino]Ethyl]Amino]Acetate; Copper Trisodium 2-[Bis[2-[Bis(2-Oxido-2-Oxo-Ethyl)Amino]Ethyl]Amino]Ethanoate
• Molecular Formula: C₁₄H₁₈CuN₃Na₃O₁₀
• Molecular Weight: 520.83
• CAS Registry Number: 12189-76-3
• EINECS: 235-361-5
• SMILES: [Na+].[Na+].[Na+].[O-]C(=O)CN(CCN(CC([O-])=O)CC([O-])=O)CCN(CC([O-])=O)CC([O-])=O.[Cu++]
• InChI: 1S/C14H23N3O10.Cu.3Na/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;+2;3*+1/p-5
• InChIKey: HCTYKKYNCVSXEC-UHFFFAOYSA-I

Properties

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