5-[[3-[[3-Carbamoyl-5-(2,3-Dihydroxypropylcarbamoyl)-2,4,6-Triiodophenyl]-(2,3-Dihydroxypropyl)Amino]-3-Oxopropanoyl]-(2,3-Dihydroxypropyl)Amino]-N'-(2,3-Dihydroxypropyl)-2,4,6-Triiodobenzene-1,3-Dicarboxamide
[CAS# 181872-90-2]

Identification

• Name: 5-[[3-[[3-Carbamoyl-5-(2,3-Dihydroxypropylcarbamoyl)-2,4,6-Triiodophenyl]-(2,3-Dihydroxypropyl)Amino]-3-Oxopropanoyl]-(2,3-Dihydroxypropyl)Amino]-N'-(2,3-Dihydroxypropyl)-2,4,6-Triiodobenzene-1,3-Dicarboxamide
• Synonyms: 5-[[3-[[3-Carbamoyl-5-(2,3-Dihydroxypropylcarbamoyl)-2,4,6-Triiodo-Phenyl]-(2,3-Dihydroxypropyl)Amino]-3-Oxo-Propanoyl]-(2,3-Dihydroxypropyl)Amino]-N'-(2,3-Dihydroxypropyl)-2,4,6-Triiodo-Benzene-1,3-Dicarboxamide; 5-[[3-[[3-Carbamoyl-5-[(2,3-Dihydroxypropylamino)-Oxomethyl]-2,4,6-Triiodophenyl]-(2,3-Dihydroxypropyl)Amino]-1,3-Dioxopropyl]-(2,3-Dihydroxypropyl)Amino]-N'-(2,3-Dihydroxypropyl)-2,4,6-Triiodobenzene-1,3-Dicarboxamide; 5-[[3-[[3-Carbamoyl-5-(Glycerylcarbamoyl)-2,4,6-Triiodo-Phenyl]-Glyceryl-Amino]-3-Keto-Propanoyl]-Glyceryl-Amino]-N'-Glyceryl-2,4,6-Triiodo-Isophthalamide
• Molecular Formula: C₃₁H₃₆I₆N₆O₁₄
• Molecular Weight: 1478.08
• CAS Registry Number: 181872-90-2
• SMILES: C(C(N(C1=C(C(=C(C(=C1I)C(NCC(O)CO)=O)I)C(=O)N)I)CC(O)CO)=O)C(N(C2=C(C(=C(I)C(=C2I)C(NCC(O)CO)=O)C(=O)N)I)CC(O)CO)=O
• InChI: 1S/C31H36I6N6O14/c32-20-16(28(38)54)22(34)26(24(36)18(20)30(56)40-2-10(48)6-44)42(4-12(50)8-46)14(52)1-15(53)43(5-13(51)9-47)27-23(35)17(29(39)55)21(33)19(25(27)37)31(57)41-3-11(49)7-45/h10-13,44-51H,1-9H2,(H2,38,54)(H2,39,55)(H,40,56)(H,41,57)
• InChIKey: DLPPIGPJCKKVBA-UHFFFAOYSA-N

Properties

• Density: 2.459g/cm³ (Cal.)
• Boiling point: 1189.929°C at 760 mmHg (Cal.)
• Flash point: 673.445°C (Cal.)