N,N'-Dicarboxymethyldiaza-18-Crown-6
[CAS# 72912-01-7]

Identification

• Name: N,N'-Dicarboxymethyldiaza-18-Crown-6
• Synonyms: 2-[16-(2-Oxido-2-Oxo-Ethyl)-1,4,10,13-Tetraoxa-7,16-Diazoniacyclooctadec-7-Yl]Acetate; 2-[16-(2-Keto-2-Oxido-Ethyl)-1,4,10,13-Tetraoxa-7,16-Diazoniacyclooctadec-7-Yl]Acetate; 2-[16-(2-Oxido-2-Oxo-Ethyl)-1,4,10,13-Tetraoxa-7,16-Diazoniacyclooctadec-7-Yl]Ethanoate
• Molecular Formula: C₁₆H₃₀N₂O₈
• Molecular Weight: 378.42
• CAS Registry Number: 72912-01-7
• SMILES: C([NH+]1CCOCCOCC[NH+](CCOCCOCC1)CC([O-])=O)C([O-])=O
• InChI: 1S/C16H30N2O8/c19-15(20)13-17-1-5-23-9-10-25-7-3-18(14-16(21)22)4-8-26-12-11-24-6-2-17/h1-14H2,(H,19,20)(H,21,22)
• InChIKey: NCKZZTXKSYMGTD-UHFFFAOYSA-N

Properties

• Density: 1.147g/cm³ (Cal.)
• Boiling point: 584.737°C at 760 mmHg (Cal.)
• Flash point: 307.438°C (Cal.)