4-Oxo-4-[Propyl-(2,4,6-Triiodo-3-Propoxyphenyl)Amino]Butanoic Acid
[CAS# 37938-70-8]

Identification

• Name: 4-Oxo-4-[Propyl-(2,4,6-Triiodo-3-Propoxyphenyl)Amino]Butanoic Acid
• Synonyms: 4-Oxo-4-[Propyl-(2,4,6-Triiodo-3-Propoxy-Phenyl)Amino]Butanoic Acid; 4-Keto-4-[Propyl-(2,4,6-Triiodo-3-Propoxy-Phenyl)Amino]Butyric Acid; 3'-Propoxy-N-Propyl-2',4',6'-Triiodosuccinanilic Acid
• Molecular Formula: C₁₆H₂₀I₃NO₄
• Molecular Weight: 671.05
• CAS Registry Number: 37938-70-8
• SMILES: C1=C(C(=C(C(=C1I)N(C(CCC(=O)O)=O)CCC)I)OCCC)I
• InChI: 1S/C16H20I3NO4/c1-3-7-20(12(21)5-6-13(22)23)15-10(17)9-11(18)16(14(15)19)24-8-4-2/h9H,3-8H2,1-2H3,(H,22,23)
• InChIKey: ALBBSSRMMPGXEM-UHFFFAOYSA-N

Properties

• Density: 2.065g/cm³ (Cal.)
• Boiling point: 646.735°C at 760 mmHg (Cal.)
• Flash point: 344.933°C (Cal.)