[3-(N-Benzylacetylamino)-2,4,6-Triiodophenyl]Acetic Acid
[CAS# 29193-35-9]

Identification

• Name: [3-(N-Benzylacetylamino)-2,4,6-Triiodophenyl]Acetic Acid
• Synonyms: 2-[3-(Acetyl-(Phenylmethyl)Amino)-2,4,6-Triiodo-Phenyl]Acetic Acid; 2-[3-(Acetyl-(Benzyl)Amino)-2,4,6-Triiodo-Phenyl]Acetic Acid; 2-[3-(Ethanoyl-(Phenylmethyl)Amino)-2,4,6-Triiodo-Phenyl]Ethanoic Acid
• Molecular Formula: C₁₇H₁₄I₃NO₃
• Molecular Weight: 661.02
• CAS Registry Number: 29193-35-9
• SMILES: C1=C(C(=C(C(=C1I)N(CC2=CC=CC=C2)C(C)=O)I)CC(O)=O)I
• InChI: 1S/C17H14I3NO3/c1-10(22)21(9-11-5-3-2-4-6-11)17-14(19)8-13(18)12(16(17)20)7-15(23)24/h2-6,8H,7,9H2,1H3,(H,23,24)
• InChIKey: WPUJBEYLMDWODI-UHFFFAOYSA-N

Properties

• Density: 2.238g/cm³ (Cal.)
• Boiling point: 674.939°C at 760 mmHg (Cal.)
• Flash point: 361.99°C (Cal.)