Ioxotrizoic Acid
[CAS# 19863-06-0]

Identification

• Name: Ioxotrizoic Acid
• Synonyms: 3-Acetamido-5-[(2-Hydroxyacetyl)Amino]-2,4,6-Triiodo-Benzoic Acid; 3-Acetamido-5-[(2-Hydroxy-1-Oxoethyl)Amino]-2,4,6-Triiodobenzoic Acid; 3-Acetamido-5-(Glycoloylamino)-2,4,6-Triiodo-Benzoic Acid
• Molecular Formula: C₁₁H₉I₃N₂O₅
• Molecular Weight: 629.92
• CAS Registry Number: 19863-06-0
• SMILES: C(C(NC1=C(C(=C(I)C(=C1I)C(O)=O)NC(C)=O)I)=O)O
• InChI: 1S/C11H9I3N2O5/c1-3(18)15-9-6(12)5(11(20)21)7(13)10(8(9)14)16-4(19)2-17/h17H,2H2,1H3,(H,15,18)(H,16,19)(H,20,21)
• InChIKey: KISFRFNQZTVXGT-UHFFFAOYSA-N

Properties

• Density: 2.717g/cm³ (Cal.)
• Boiling point: 660.205°C at 760 mmHg (Cal.)
• Flash point: 353.08°C (Cal.)