(3,4-Bispyridinium-1,1-dimethyl)urea diiodide
1-(1-methylpyridin-1-ium-3-yl)-3-(1-methylpyridin-1-ium-4-yl)urea diiodide
Also Known As: HH54|HH 54|(3,4-Bispyridinium-1,1-dimethyl)urea diiodide|methyl 8-methylsulfanyl-9-oxodecanoate|tert-butyl 8-methylsulfanyl-9-oxodecanoate|1,3-bis(1-methylpyridin-1-ium-3-yl)thiourea,diiodide|1,2-bis(1-methylpyridin-1-ium-3-yl)guanidine,diiodide|Pyridinium, 1-methyl-3-((((1-methylpyridinium-4-yl)amino)carbonyl)amino)-, diiodide|1-(1-methylpyridin-1-ium-3-yl)-3-(1-methylpyridin-1-ium-4-yl)urea;diiodide|1-(1-methylpyridin-1-ium-3-yl)-3-(1-methylpyridin-1-ium-4-yl)urea diiodide|1-(1-methylpyridin-1-ium-3-yl)-3-(1-methylpyridin-1-ium-4-yl)urea,diiodide
| Molecular Formula | C13H16I2N4O |
|---|---|
| Molecular Weight | 497.94135 g/mol |
| LogP | -5.0124 |
| Topological Polar Surface Area | 48.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 497.94135 |
| Monoisotopic Mass | 497.94135 |
| Heavy Atoms | 20 |
| Complexity | 276.0 |
Chemical Identifiers
| CAS Number | 61369-17-3 |
|---|---|
| SMILES | C[N+]1=CC=C(C=C1)NC(=O)NC2=C[N+](=CC=C2)C.[I-].[I-] |
| InChIKey | HBWHPDPDTOIVLW-UHFFFAOYSA-N |
Product Overview
(3,4-Bispyridinium-1,1-dimethyl)urea diiodide (CAS 61369-17-3), with molecular formula C13H16I2N4O and molecular weight 497.94135 g/mol. IUPAC: 1-(1-methylpyridin-1-ium-3-yl)-3-(1-methylpyridin-1-ium-4-yl)urea diiodide.