3-(3-Oxomorpholino)-2,4,6-Triiodophenylacetic Acid Sodium Salt
[CAS# 21838-47-1]

Identification

• Name: 3-(3-Oxomorpholino)-2,4,6-Triiodophenylacetic Acid Sodium Salt
• Synonyms: Sodium 2-[2,4,6-Triiodo-3-(3-Oxo-4-Morpholinyl)Phenyl]Acetate; Sodium 2-[2,4,6-Triiodo-3-(3-Ketomorpholin-4-Yl)Phenyl]Acetate; Sodium 2-[2,4,6-Triiodo-3-(3-Oxomorpholin-4-Yl)Phenyl]Ethanoate
• Molecular Formula: C₁₂H₉I₃NNaO₄
• Molecular Weight: 634.91
• CAS Registry Number: 21838-47-1
• SMILES: C1=C(I)C(=C(I)C(=C1I)CC([O-])=O)N2C(=O)COCC2.[Na+]
• InChI: 1S/C12H10I3NO4.Na/c13-7-4-8(14)12(11(15)6(7)3-10(18)19)16-1-2-20-5-9(16)17;/h4H,1-3,5H2,(H,18,19);/q;+1/p-1
• InChIKey: ZMPLHCWTBUEIEU-UHFFFAOYSA-M

Properties

• Boiling point: 708.6°C at 760 mmHg (Cal.)
• Flash point: 382.3°C (Cal.)