RefChem:318796
[2-(dimethylcarbamoyloxy)-4-(2,2-dimethylpropyl)phenyl]-trimethylazanium iodide
Also Known As: AC1L1PNY|RefChem:318796|(2-Hydroxy-5-tert-pentylphenyl)trimethylammonium iodide dimethylcarbamate|Ammonium, (2-hydroxy-5-tert-pentylphenyl)trimethyl-, iodide, dimethylcarbamate (ester)|[2-(Dimethylcarbamoyloxy)-4-(2,2-dimethylpropyl)phenyl]-trimethylazaniumiodide|[2-(dimethylcarbamoyloxy)-4-(2,2-dimethylpropyl)phenyl]-trimethylazanium|[2-(dimethylcarbamoyloxy)-4-(2,2-dimethylpropyl)phenyl]-trimethylazanium iodide|2-[(Dimethylcarbamoyl)oxy]-4-(2,2-dimethylpropyl)-N,N,N-trimethylanilinium iodide
| Molecular Formula | C17H29IN2O2 |
|---|---|
| Molecular Weight | 420.12738 g/mol |
| LogP | 0.54 |
| Topological Polar Surface Area | 29.54 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 420.12738 |
| Heavy Atoms | 22 |
| Complexity | 514.4 |
Chemical Identifiers
| CAS Number | 101710-54-7 |
|---|---|
| SMILES | CC(C)(C)CC1=CC(=C(C=C1)[N+](C)(C)C)OC(=O)N(C)C.[I-] |
Product Overview
RefChem:318796 (CAS 101710-54-7), with molecular formula C17H29IN2O2 and molecular weight 420.12738 g/mol. IUPAC: [2-(dimethylcarbamoyloxy)-4-(2,2-dimethylpropyl)phenyl]-trimethylazanium iodide.
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