3-[4-[(3-Amino-2,4,6-Triiodo-Benzoyl)Amino]Phenyl]Propanoic Acid
[CAS# 22708-48-1]

Identification

• Name: 3-[4-[(3-Amino-2,4,6-Triiodo-Benzoyl)Amino]Phenyl]Propanoic Acid
• Synonyms: 3-[4-[(3-Amino-2,4,6-Triiodo-Benzoyl)Amino]Phenyl]Propanoic Acid; 3-[4-[[(3-Amino-2,4,6-Triiodophenyl)-Oxomethyl]Amino]Phenyl]Propanoic Acid; 3-[4-[(3-Amino-2,4,6-Triiodo-Benzoyl)Amino]Phenyl]Propionic Acid
• Molecular Formula: C₁₆H₁₃I₃N₂O₃
• Molecular Weight: 662.00
• CAS Registry Number: 22708-48-1
• SMILES: C1=C(I)C(=C(I)C(=C1I)C(=O)NC2=CC=C(C=C2)CCC(=O)O)N
• InChI: 1S/C16H13I3N2O3/c17-10-7-11(18)15(20)14(19)13(10)16(24)21-9-4-1-8(2-5-9)3-6-12(22)23/h1-2,4-5,7H,3,6,20H2,(H,21,24)(H,22,23)
• InChIKey: MFJHJTQAGFREML-UHFFFAOYSA-N

Properties

• Density: 2.358g/cm³ (Cal.)
• Boiling point: 616.209°C at 760 mmHg (Cal.)
• Flash point: 326.471°C (Cal.)