1-{2-[(3,7-dimethyloctyl)oxy]-2-oxoethyl}-1-methylpiperidin-1-ium--iodide (1/1)
Chemical Structure Depiction of
1-{2-[(3,7-dimethyloctyl)oxy]-2-oxoethyl}-1-methylpiperidin-1-ium--iodide (1/1)
1-{2-[(3,7-dimethyloctyl)oxy]-2-oxoethyl}-1-methylpiperidin-1-ium--iodide (1/1)
Compound characteristics
| Compound ID: | 6228-0272 |
| Compound Name: | 1-{2-[(3,7-dimethyloctyl)oxy]-2-oxoethyl}-1-methylpiperidin-1-ium--iodide (1/1) |
| Molecular Weight: | 425.39 |
| Molecular Formula: | C18 H36 N O2 |
| Salt: | I- |
| Smiles: | CC(C)CCCC(C)CCOC(C[N+]1(C)CCCCC1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.3653 |
| logD: | 4.3653 |
| logSw: | -4.0088 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 21.3694 |
| InChI Key: | FESWBDCXEBOLRE-KRWDZBQOSA-N |