2-Phenyl-2-(3-Propionylamino-2,4,6-Triiodophenoxy)Acetic Acid
[CAS# 23189-37-9]

Identification

• Name: 2-Phenyl-2-(3-Propionylamino-2,4,6-Triiodophenoxy)Acetic Acid
• Synonyms: 2-Phenyl-2-[2,4,6-Triiodo-3-(1-Oxopropylamino)Phenoxy]Acetic Acid; 2-Phenyl-2-(2,4,6-Triiodo-3-Propionamido-Phenoxy)Acetic Acid; 2-Phenyl-2-[2,4,6-Triiodo-3-(Propanoylamino)Phenoxy]Ethanoic Acid
• Molecular Formula: C₁₇H₁₄I₃NO₄
• Molecular Weight: 677.02
• CAS Registry Number: 23189-37-9
• SMILES: C1=C(C(=C(C(=C1I)OC(C2=CC=CC=C2)C(O)=O)I)NC(CC)=O)I
• InChI: 1S/C17H14I3NO4/c1-2-12(22)21-14-10(18)8-11(19)16(13(14)20)25-15(17(23)24)9-6-4-3-5-7-9/h3-8,15H,2H2,1H3,(H,21,22)(H,23,24)
• InChIKey: YNEKBWZFNXQGKA-UHFFFAOYSA-N

Properties

• Density: 2.243g/cm³ (Cal.)
• Boiling point: 666.076°C at 760 mmHg (Cal.)
• Flash point: 356.63°C (Cal.)