3,3'-[Oxybis[2,1-ethanediyloxy(1-oxo-3,1-propanediyl)imino]]bis[2,4,6-triiodo-Benzoic acid]
[CAS# 26887-04-7]

Identification

• Name: 3,3'-[Oxybis[2,1-ethanediyloxy(1-oxo-3,1-propanediyl)imino]]bis[2,4,6-triiodo-Benzoic acid]
• Synonyms: 3-[3-[2-[2-[3-[(3-Carboxy-2,4,6-Triiodo-Phenyl)Amino]-3-Oxo-Propoxy]Ethoxy]Ethoxy]Propanoylamino]-2,4,6-Triiodo-Benzoic Acid; 3-[[3-[2-[2-[3-[(3-Carboxy-2,4,6-Triiodophenyl)Amino]-3-Oxopropoxy]Ethoxy]Ethoxy]-1-Oxopropyl]Amino]-2,4,6-Triiodobenzoic Acid; 3-[3-[2-[2-[3-[(3-Carboxy-2,4,6-Triiodo-Phenyl)Amino]-3-Keto-Propoxy]Ethoxy]Ethoxy]Propanoylamino]-2,4,6-Triiodo-Benzoic Acid
• Molecular Formula: C₂₄H₂₂I₆N₂O₉
• Molecular Weight: 1243.87
• CAS Registry Number: 26887-04-7
• SMILES: C1=C(C(=C(C(=C1I)C(O)=O)I)NC(CCOCCOCCOCCC(NC2=C(C(=C(I)C=C2I)C(O)=O)I)=O)=O)I
• InChI: 1S/C24H22I6N2O9/c25-11-9-13(27)21(19(29)17(11)23(35)36)31-15(33)1-3-39-5-7-41-8-6-40-4-2-16(34)32-22-14(28)10-12(26)18(20(22)30)24(37)38/h9-10H,1-8H2,(H,31,33)(H,32,34)(H,35,36)(H,37,38)
• InChIKey: WIHNMHCKXOKXHG-UHFFFAOYSA-N

Properties

• Density: 2.528g/cm³ (Cal.)
• Boiling point: 957.897°C at 760 mmHg (Cal.)
• Flash point: 533.117°C (Cal.)