5-Acetylamino-N,N-Dimethyl-2,4,6-Triiodoisophthalamic Acid Sodium Salt
[CAS# 67292-81-3]

Identification

• Name: 5-Acetylamino-N,N-Dimethyl-2,4,6-Triiodoisophthalamic Acid Sodium Salt
• Synonyms: Sodium 3-Acetamido-5-(Dimethylcarbamoyl)-2,4,6-Triiodo-Benzoate; Sodium 3-Acetamido-5-(Dimethylamino-Oxomethyl)-2,4,6-Triiodobenzoate; 5-Acetylamino-N,N-Dimethyl-2,4,6-Triiodoisophthalamic Acid Sodium Salt
• Molecular Formula: C₁₂H₁₀I₃N₂NaO₄
• Molecular Weight: 649.93
• CAS Registry Number: 67292-81-3
• SMILES: CN(C(=O)C1=C(I)C(=C(I)C(=C1I)NC(=O)C)C([O-])=O)C.[Na+]
• InChI: 1S/C12H11I3N2O4.Na/c1-4(18)16-10-8(14)5(11(19)17(2)3)7(13)6(9(10)15)12(20)21;/h1-3H3,(H,16,18)(H,20,21);/q;+1/p-1
• InChIKey: BYJLZYLNMKMOGY-UHFFFAOYSA-M

Properties

• Boiling point: 659.3°C at 760 mmHg (Cal.)
• Flash point: 352.5°C (Cal.)