Ethyl 3-[[6-[(3-Ethoxycarbonyl-2,4,6-Triiodophenyl)Amino]-6-Oxohexanoyl]Amino]-2,4,6-Triiodobenzoate
[CAS# 76994-60-0]

Identification

• Name: Ethyl 3-[[6-[(3-Ethoxycarbonyl-2,4,6-Triiodophenyl)Amino]-6-Oxohexanoyl]Amino]-2,4,6-Triiodobenzoate
• Synonyms: Ethyl 3-[[6-[(3-Ethoxycarbonyl-2,4,6-Triiodo-Phenyl)Amino]-6-Oxo-Hexanoyl]Amino]-2,4,6-Triiodo-Benzoate; 3-[[6-[(3-Ethoxycarbonyl-2,4,6-Triiodophenyl)Amino]-1,6-Dioxohexyl]Amino]-2,4,6-Triiodobenzoic Acid Ethyl Ester; 3-[[6-[(3-Carbethoxy-2,4,6-Triiodo-Phenyl)Amino]-6-Keto-Hexanoyl]Amino]-2,4,6-Triiodo-Benzoic Acid Ethyl Ester
• Molecular Formula: C₂₄H₂₂I₆N₂O₆
• Molecular Weight: 1195.87
• CAS Registry Number: 76994-60-0
• SMILES: C1=C(I)C(=C(I)C(=C1I)NC(=O)CCCCC(=O)NC2=C(I)C=C(I)C(=C2I)C(OCC)=O)C(OCC)=O
• InChI: 1S/C24H22I6N2O6/c1-3-37-23(35)17-11(25)9-13(27)21(19(17)29)31-15(33)7-5-6-8-16(34)32-22-14(28)10-12(26)18(20(22)30)24(36)38-4-2/h9-10H,3-8H2,1-2H3,(H,31,33)(H,32,34)
• InChIKey: HBWRDJPOMZHLRU-UHFFFAOYSA-N

Properties

• Density: 2.437g/cm³ (Cal.)
• Boiling point: 888.13°C at 760 mmHg (Cal.)
• Flash point: 490.923°C (Cal.)