Introduction：Basic information about IOMEPROL CAS 78649-41-9, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
IOMEPROL Basic information
| Product Name: | IOMEPROL |
| Synonyms: | N1,N3-bis(2,3-dihydroxypropyl)-5-(2-hydroxy-N-methylacetamido)-2,4,6-triiodoisophthalamide;IOMEPROL;1,3-Benzenedicarboxamide, N,N'-bis(2,3-dihydroxypropyl)-5-[(hydroxyacetyl)methylamino]-2,4,6-triiodo-;Imeron;Iomeron 350;Iomeron;N,N'-bis(2,3-dihydroxypropyl)-5-[(hydroxyacetyl)methylamino]-2,4,6-triiodo-1,3-benzenedicarboxamide;N,N'-Bis(2,3-dihydroxypropyl)-5-[methyl(hydroxyacetyl)amino]-2,4,6-triiodoisophthalamide |
| CAS: | 78649-41-9 |
| MF: | C17H22I3N3O8 |
| MW: | 777.09 |
| EINECS: | 1533716-785-6 |
| Product Categories: | Intermediates & Fine Chemicals;Pharmaceuticals;pharmacetical |
| Mol File: | 78649-41-9.mol |
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IOMEPROL Chemical Properties
| Melting point | 263-265?C |
| Boiling point | 813.2±65.0 °C(Predicted) |
| density | d420 1.166; d437 1.161; d420 1.334; d437 1.329; d420 1.446; d437 1.441 |
| refractive index | nD20 1.3828; nD20 1.4327; nD20 1.4660 |
| storage temp. | -20°C Freezer |
| solubility | DMSO (Slightly), Methanol (Slightly) |
| pka | 11.36±0.46(Predicted) |
| form | Solid |
| color | White to Off-White |
| InChI | InChI=1S/C17H22I3N3O8/c1-23(9(29)6-26)15-13(19)10(16(30)21-2-7(27)4-24)12(18)11(14(15)20)17(31)22-3-8(28)5-25/h7-8,24-28H,2-6H2,1H3,(H,21,30)(H,22,31) |
| InChIKey | NJKDOADNQSYQEV-UHFFFAOYSA-N |
| SMILES | C1(C(NCC(O)CO)=O)=C(I)C(N(C(CO)=O)C)=C(I)C(C(NCC(O)CO)=O)=C1I |
| CAS DataBase Reference | 78649-41-9(CAS DataBase Reference) |
| EPA Substance Registry System | 1,3-Benzenedicarboxamide, N1,N3-bis(2,3-dihydroxypropyl)-5-[(2-hydroxyacetyl)methylamino]-2,4,6-triiodo- (78649-41-9) |
Safety Information
| Toxicity | LD50 (400 mgI/ml soln) i.v. in mice, rats (gI/kg): 19.9, 14.5; LD50 (370 mgI/ml soln) i.v. in dogs (gI/kg): >12.5 (Morisetti) |
IOMEPROL Usage And Synthesis
| Chemical Properties | White Solid |
| Uses | Diagnostic aid (radiopaque medium). |
| Definition | ChEBI: A benzenedicarboxamide compound having N-substituted carbamoyl groups at the 1- and 3-positions, iodo substituents at the 2-, 4- and 6-positions and a glycoloyl(methyl)amino group at the 5-position. |
| Hazard | Low toxicity. |
IOMEPROL Preparation Products And Raw materials
| Raw materials | 5-AMino-N,N'-bis(2,3-dihydroxypropyl)-2,4,6-triiodo-1,3-benzenedicarboxaMide Tetraacetate-->5-Amino-2,4,6-triiodoisophthaloyl dichloride-->5-Amino-N,N'-bis(2,3-dihydroxypropyl)-2,4,6-triiodo-1,3-benzenedicarboxamide-->N-DesMethyl IoMeprol-->5-[[2-(Acetyloxy)acetyl]amino]-2,4,6-triiodo-1,3-benzenedicarbonyl Dichloride-->5-Aminoisophthalic acid-->Dimethyl sulfate-->Iodomethane |
