Denatonium chloride
benzyl-[2-(2,6-dimethylanilino)-2-oxoethyl]-diethylazanium chloride
Also Known As: Denatonium Chloride, Denatoniumchloride, DENATONIUM CHLORIDE [VANDF], MSK160891-1000MW, Benzyldiethyl((2,6-xylylcarbamoyl)methyl)ammonium chloride, Benzenemethanaminium, N-(2-((2,6-dimethylphenyl)amino)-2-oxoethyl)-N,N-diethyl-, chloride, benzyl-[2-(2,6-dimethylanilino)-2-oxoethyl]-diethylazanium;chloride, Ammonium, benzyldiethyl((2,6-xylylcarbamoyl)methyl)-, chloride, benzyl-[2-(2,6-dimethylanilino)-2-oxoethyl]-diethylazanium,chloride, Denatonium chloride Solution in Methanol/Water, 1000ug/mL, N-(2-((2,6-DIMETHYLPHENYL)AMINO)-2-OXOETHYL)-N,N-DIETHYLBENZENEMETHANAMINIUM CHLORIDE, benzyl-[2-(2,6-dimethylanilino)-2-oxoethyl]-diethylazanium chloride, benzyl-[2-(2,6-dimethylanilino)-2-oxo-ethyl]-diethyl-ammonium chloride, Benzenemethanaminium, N-[2-[(2,6-dimethylphenyl)amino]-2-oxoethyl]-N,N-diethyl-, chloride, Benzenemethanaminium,N-(2-((2,6-dimethylphenyl)amino)-2-oxoethyl)-N,N-diethyl-,chloride
| Molecular Formula | C21H29ClN2O |
|---|---|
| Molecular Weight | 360.19684 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 7 |
| Exact Mass | 360.19684 |
| Heavy Atoms | 25 |
| Complexity | 661 |
Chemical Identifiers
| CAS Number | 1674-99-3 |
|---|---|
| SMILES | CC[N+](CC)(CC1=CC=CC=C1)CC(=O)NC2=C(C=CC=C2C)C.[Cl-] |
Product Overview
Denatonium chloride (CAS 1674-99-3), with molecular formula C21H29ClN2O and molecular weight 360.19684 g/mol. IUPAC: benzyl-[2-(2,6-dimethylanilino)-2-oxoethyl]-diethylazanium chloride.
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