1-{[2-(cyclohex-3-en-1-yl)-1,3-dioxolan-4-yl]methyl}-1-methylpiperidin-1-ium--iodide (1/1)
Chemical Structure Depiction of
1-{[2-(cyclohex-3-en-1-yl)-1,3-dioxolan-4-yl]methyl}-1-methylpiperidin-1-ium--iodide (1/1)
1-{[2-(cyclohex-3-en-1-yl)-1,3-dioxolan-4-yl]methyl}-1-methylpiperidin-1-ium--iodide (1/1)
Compound characteristics
| Compound ID: | 5212-2910 |
| Compound Name: | 1-{[2-(cyclohex-3-en-1-yl)-1,3-dioxolan-4-yl]methyl}-1-methylpiperidin-1-ium--iodide (1/1) |
| Molecular Weight: | 393.31 |
| Molecular Formula: | C16 H28 N O2 |
| Salt: | I- |
| Smiles: | C[N+]1(CCCCC1)CC1COC(C2CCC=CC2)O1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.9266 |
| logD: | 2.9266 |
| logSw: | -2.7071 |
| Hydrogen bond acceptors count: | 2 |
| Polar surface area: | 17.4754 |
| InChI Key: | NEBXMGQNBFPSNC-UHFFFAOYSA-N |