1,3-Diaminopropanetetraacetic acid iron(III) ammonium salt
[CAS# 111687-36-6]

Identification

• Name: 1,3-Diaminopropanetetraacetic acid iron(III) ammonium salt
• Synonyms: Ammonium Ferric 2-[3-[Bis(2-Oxido-2-Oxo-Ethyl)Amino]Propyl-(2-Oxido-2-Oxo-Ethyl)Amino]Acetate; Ammonium Ferric 2-[3-[Bis(2-Oxido-2-Oxoethyl)Amino]Propyl-(2-Oxido-2-Oxoethyl)Amino]Acetate; Ammonium Ferric 2-[3-[Bis(2-Keto-2-Oxido-Ethyl)Amino]Propyl-(2-Keto-2-Oxido-Ethyl)Amino]Acetate
• Molecular Formula: C₁₁H₁₈FeN₃O₈
• Molecular Weight: 376.13
• CAS Registry Number: 111687-36-6
• SMILES: C(CN(CC([O-])=O)CC([O-])=O)CN(CC([O-])=O)CC([O-])=O.[NH4+].[Fe+3]
• InChI: 1S/C11H18N2O8.Fe.H3N/c14-8(15)4-12(5-9(16)17)2-1-3-13(6-10(18)19)7-11(20)21;;/h1-7H2,(H,14,15)(H,16,17)(H,18,19)(H,20,21);;1H3/q;+3;/p-3
• InChIKey: HXPRIPOCSQBZIN-UHFFFAOYSA-K

Properties

• Boiling point: 620.5°C at 760 mmHg (Cal.)
• Flash point: 329.1°C (Cal.)