3-(Acetylamino)-5-[2-[(2-Hydroxyethyl)Amino]-2-Oxoethyl]-2,4,6-Triiodobenzoic Acid
[CAS# 40590-66-7]

Identification

• Name: 3-(Acetylamino)-5-[2-[(2-Hydroxyethyl)Amino]-2-Oxoethyl]-2,4,6-Triiodobenzoic Acid
• Synonyms: 3-Acetamido-5-[2-(2-Hydroxyethylamino)-2-Oxo-Ethyl]-2,4,6-Triiodo-Benzoic Acid; 3-Acetamido-5-[2-(2-Hydroxyethylamino)-2-Keto-Ethyl]-2,4,6-Triiodo-Benzoic Acid; Acetanilide, 3-Carboxy-5-(2-Hydroxyethylcarbamoylmethyl)-2,4,6-Triiodo-
• Molecular Formula: C₁₃H₁₃I₃N₂O₅
• Molecular Weight: 657.97
• CAS Registry Number: 40590-66-7
• SMILES: C(C1=C(C(=C(C(=C1I)C(O)=O)I)NC(C)=O)I)C(NCCO)=O
• InChI: 1S/C13H13I3N2O5/c1-5(20)18-12-10(15)6(4-7(21)17-2-3-19)9(14)8(11(12)16)13(22)23/h19H,2-4H2,1H3,(H,17,21)(H,18,20)(H,22,23)
• InChIKey: AMZAGJCNCHZARH-UHFFFAOYSA-N

Properties

• Density: 2.432g/cm³ (Cal.)
• Boiling point: 741.615°C at 760 mmHg (Cal.)
• Flash point: 402.314°C (Cal.)