2-[2-(3-Acetamido-2,4,6-Triiodo-Phenoxy)Ethoxy]Propanoic Acid
[CAS# 22730-89-8]

Identification

• Name: 2-[2-(3-Acetamido-2,4,6-Triiodo-Phenoxy)Ethoxy]Propanoic Acid
• Synonyms: 2-[2-(3-Acetamido-2,4,6-Triiodo-Phenoxy)Ethoxy]Propanoic Acid; 2-[2-(3-Acetamido-2,4,6-Triiodo-Phenoxy)Ethoxy]Propionic Acid; Brn 2777870
• Molecular Formula: C₁₃H₁₄I₃NO₅
• Molecular Weight: 644.97
• CAS Registry Number: 22730-89-8
• SMILES: C1=C(C(=C(C(=C1I)OCCOC(C(=O)O)C)I)NC(=O)C)I
• InChI: 1S/C13H14I3NO5/c1-6(13(19)20)21-3-4-22-12-9(15)5-8(14)11(10(12)16)17-7(2)18/h5-6H,3-4H2,1-2H3,(H,17,18)(H,19,20)
• InChIKey: VQIVOLHFBFAWBD-UHFFFAOYSA-N

Properties

• Density: 2.302g/cm³ (Cal.)
• Boiling point: 684.5°C at 760 mmHg (Cal.)
• Flash point: 367.772°C (Cal.)