2-[Bis[2-[(2-Methylamino-2-Oxoethyl)-(2-Oxido-2-Oxoethyl)Amino]Ethyl]Amino]Acetate Hydrate
[CAS# 138721-73-0]

Identification

• Name: 2-[Bis[2-[(2-Methylamino-2-Oxoethyl)-(2-Oxido-2-Oxoethyl)Amino]Ethyl]Amino]Acetate Hydrate
• Synonyms: 2-[Bis[2-[(2-Methylamino-2-Oxo-Ethyl)-(2-Oxido-2-Oxo-Ethyl)Amino]Ethyl]Amino]Acetate Hydrate; 2-[Bis[2-[(2-Keto-2-Methylamino-Ethyl)-(2-Keto-2-Oxido-Ethyl)Amino]Ethyl]Amino]Acetate Hydrate; 2-[Bis[2-[(2-Methylamino-2-Oxo-Ethyl)-(2-Oxido-2-Oxo-Ethyl)Amino]Ethyl]Amino]Ethanoate Hydrate
• Molecular Formula: C₁₆H₂₈N₅O₉
• Molecular Weight: 434.43
• CAS Registry Number: 138721-73-0
• SMILES: C(N(CCN(CC(=O)NC)CC([O-])=O)CC([O-])=O)CN(CC(=O)NC)CC([O-])=O.O
• InChI: 1S/C16H29N5O8.H2O/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);1H2/p-3
• InChIKey: XPTHPEXVBYEOPW-UHFFFAOYSA-K

Properties

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