CTK4G0966
trimethyl-[2-[4-oxo-4-[2-(trimethylazaniumyl)ethoxy]but-2-enoyl]oxyethyl]azanium diiodide
Also Known As: Choline, iodide, maleate (2:1)|Choline, iodide,maleate (2:1) (8CI)|(2-Hydroxyethyl)trimethylammonium iodide maleate (2:1)|Ammonium, (2-hydroxyethyl)trimethyl-, iodide, maleate (2:1)
CAS: 28173-47-9
| Molecular Formula | C14H28I2N2O4 |
|---|---|
| Molecular Weight | 542.01385 g/mol |
| LogP | -5.9506 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 10 |
| Exact Mass | 542.01385 |
| Monoisotopic Mass | 542.01385 |
| Heavy Atoms | 22 |
| Complexity | 317.0 |
Chemical Identifiers
| CAS Number | 28173-47-9 |
|---|---|
| SMILES | C[N+](C)(C)CCOC(=O)C=CC(=O)OCC[N+](C)(C)C.[I-].[I-] |
| InChIKey | UCTSUCNPHOPEPQ-UHFFFAOYSA-L |
Product Overview
CTK4G0966 (CAS 28173-47-9), with molecular formula C14H28I2N2O4 and molecular weight 542.01385 g/mol. IUPAC: trimethyl-[2-[4-oxo-4-[2-(trimethylazaniumyl)ethoxy]but-2-enoyl]oxyethyl]azanium diiodide.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
View MSDS →
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