1-(2-hydroxy-3-phenoxypropyl)-1-methylazepan-1-ium
Chemical Structure Depiction of
1-(2-hydroxy-3-phenoxypropyl)-1-methylazepan-1-ium
1-(2-hydroxy-3-phenoxypropyl)-1-methylazepan-1-ium
Compound characteristics
| Compound ID: | 6228-0384 |
| Compound Name: | 1-(2-hydroxy-3-phenoxypropyl)-1-methylazepan-1-ium |
| Molecular Weight: | 391.29 |
| Molecular Formula: | C16 H26 N O2 |
| Salt: | I- |
| Smiles: | C[N+]1(CCCCCC1)CC(COc1ccccc1)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.9162 |
| logD: | 2.9162 |
| logSw: | -2.887 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 25.0946 |
| InChI Key: | MILWTPJYQQJHOK-HNNXBMFYSA-N |