Iotriside
[CAS# 79211-34-0]

Identification

• Name: Iotriside
• Synonyms: N3,N5-Bis(2,3-Dihydroxypropyl)-2,4,6-Triiodo-N5-Methyl-Benzene-1,3,5-Tricarboxamide; N3,N5-Diglyceryl-2,4,6-Triiodo-N5-Methyl-Benzene-1,3,5-Tricarboxamide; (- )-N,N'-Bis(2,3-Dihydroxypropyl)-2,4,6-Triiodo-N-Methyl-1,3,5-Benzenetricarboxamide.
• Molecular Formula: C₁₆H₂₀I₃N₃O₇
• Molecular Weight: 747.06
• CAS Registry Number: 79211-34-0
• SMILES: C(N(C(C1=C(C(=C(I)C(=C1I)C(N)=O)C(NCC(CO)O)=O)I)=O)C)C(CO)O
• InChI: 1S/C16H20I3N3O7/c1-22(3-7(26)5-24)16(29)10-12(18)8(14(20)27)11(17)9(13(10)19)15(28)21-2-6(25)4-23/h6-7,23-26H,2-5H2,1H3,(H2,20,27)(H,21,28)
• InChIKey: ZFOVUHQJAMLXDS-UHFFFAOYSA-N

Properties

• Density: 2.286g/cm³ (Cal.)
• Boiling point: 749.822°C at 760 mmHg (Cal.)
• Flash point: 407.278°C (Cal.)