2-[3-(N-Ethylacetylamino)-2,4,6-Triiodophenyl]Propionic Acid
[CAS# 23279-50-7]

Identification

• Name: 2-[3-(N-Ethylacetylamino)-2,4,6-Triiodophenyl]Propionic Acid
• Synonyms: 2-[3-(Acetyl-Ethyl-Amino)-2,4,6-Triiodo-Phenyl]Propanoic Acid; 2-[3-(Acetyl-Ethyl-Amino)-2,4,6-Triiodo-Phenyl]Propionic Acid; 2-[3-(Ethanoyl-Ethyl-Amino)-2,4,6-Triiodo-Phenyl]Propanoic Acid
• Molecular Formula: C₁₃H₁₄I₃NO₃
• Molecular Weight: 612.97
• CAS Registry Number: 23279-50-7
• SMILES: C1=C(C(=C(C(=C1I)C(C(=O)O)C)I)N(CC)C(=O)C)I
• InChI: 1S/C13H14I3NO3/c1-4-17(7(3)18)12-9(15)5-8(14)10(11(12)16)6(2)13(19)20/h5-6H,4H2,1-3H3,(H,19,20)
• InChIKey: OMKIDFZPIMSIQZ-UHFFFAOYSA-N

Properties

• Density: 2.283g/cm³ (Cal.)
• Boiling point: 599.199°C at 760 mmHg (Cal.)
• Flash point: 316.185°C (Cal.)