3-(Acetylethylamino)-5-Amino-2,4,6-Triiodobenzoic Acid
[CAS# 63881-24-3]

Identification

• Name: 3-(Acetylethylamino)-5-Amino-2,4,6-Triiodobenzoic Acid
• Synonyms: 3-Amino-2,4,6-Triiodo-5-[(1-Methyl-2-Oxo-Propyl)Amino]Benzoic Acid; 3-Amino-2,4,6-Triiodo-5-[(1-Methyl-2-Oxopropyl)Amino]Benzoic Acid; 3-Amino-2,4,6-Triiodo-5-[(2-Keto-1-Methyl-Propyl)Amino]Benzoic Acid
• Molecular Formula: C₁₁H₁₁I₃N₂O₃
• Molecular Weight: 599.93
• CAS Registry Number: 63881-24-3
• EINECS: 264-544-2
• SMILES: CC(NC1=C(I)C(=C(I)C(=C1I)C(=O)O)N)C(=O)C
• InChI: 1S/C11H11I3N2O3/c1-3(4(2)17)16-10-7(13)5(11(18)19)6(12)9(15)8(10)14/h3,16H,15H2,1-2H3,(H,18,19)
• InChIKey: ZWMIZBVQHWJXHT-UHFFFAOYSA-N

Properties

• Density: 2.532g/cm³ (Cal.)
• Boiling point: 573.453°C at 760 mmHg (Cal.)
• Flash point: 300.614°C (Cal.)