RefChem:357901
3,5,7-trimethyl-1-[2-(4-methylmorpholin-4-ium-4-yl)ethyl]-3H-azepin-2-one iodide
Also Known As: 4-methyl-4-[2-(3,5,7-trimethyl-2-oxo-2,3-dihydro-1h-azepin-1-yl)ethyl]morpholin-4-ium iodide|Morpholinium, 4-(2-(1,3-dihydro-2-oxo-3,5,7-trimethyl-2H-azepin-1-yl)ethyl)-4-methyl-, iodide|3,5,7-trimethyl-1-[2-(4-methylmorpholin-4-ium-4-yl)ethyl]-3H-azepin-2-one iodide
| Molecular Formula | C16H27IN2O2 |
|---|---|
| Molecular Weight | 406.11172 g/mol |
| LogP | -1.2 |
| Topological Polar Surface Area | 29.54 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 406.11172 |
| Heavy Atoms | 21 |
| Complexity | 439.6 |
Chemical Identifiers
| CAS Number | 1676-47-7 |
|---|---|
| SMILES | CC1C=C(C=C(N(C1=O)CC[N+]2(CCOCC2)C)C)C.[I-] |
Product Overview
RefChem:357901 (CAS 1676-47-7), with molecular formula C16H27IN2O2 and molecular weight 406.11172 g/mol. IUPAC: 3,5,7-trimethyl-1-[2-(4-methylmorpholin-4-ium-4-yl)ethyl]-3H-azepin-2-one iodide.
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