N,N-Bis[2-[(Carboxymethyl)[2-(Methylamino)-2-Oxoethyl]Amino]Ethyl]-Glycine Calcium Sodium Salt (1:1:1)
[CAS# 122760-91-2]

Identification

• Name: N,N-Bis[2-[(Carboxymethyl)[2-(Methylamino)-2-Oxoethyl]Amino]Ethyl]-Glycine Calcium Sodium Salt (1:1:1)
• Synonyms: Calciate(1-), (5,8-bis(carboxymethyl)-11-(2-methylamino)-2-oxoethyl)-3-oxo-2,5,8,11-tetraazatridecan-13-oato(3-)-, sodium, hydrate; Caldiamide sodium; Caldiamide sodium [USAN:BAN]
• Molecular Formula: C₁₆H₂₉CaN₅NaO₈
• Molecular Weight: 482.50
• CAS Registry Number: 122760-91-2
• SMILES: [Ca+2].[Na+].O=C(NC)CN(CC(=O)O)CCN(CCN(CC(=O)O)CC(=O)NC)CC(=O)O
• InChI: 1S/C16H29N5O8.Ca.Na/c1-17-12(22)7-20(10-15(26)27)5-3-19(9-14(24)25)4-6-21(11-16(28)29)8-13(23)18-2;;/h3-11H2,1-2H3,(H,17,22)(H,18,23)(H,24,25)(H,26,27)(H,28,29);;/q;+2;+1
• InChIKey: YOVKQJBQALQTMU-UHFFFAOYSA-N

Properties

• Boiling point: 769.1°C at 760 mmHg (Cal.)
• Flash point: 419°C (Cal.)
• Refractive index: (Cal.)