2-{2-[4-(dimethylamino)phenyl]ethenyl}-1-(3-methylbutyl)pyridin-1-ium--iodide (1/1)
Chemical Structure Depiction of
2-{2-[4-(dimethylamino)phenyl]ethenyl}-1-(3-methylbutyl)pyridin-1-ium--iodide (1/1)
2-{2-[4-(dimethylamino)phenyl]ethenyl}-1-(3-methylbutyl)pyridin-1-ium--iodide (1/1)
Compound characteristics
| Compound ID: | 3188-0030 |
| Compound Name: | 2-{2-[4-(dimethylamino)phenyl]ethenyl}-1-(3-methylbutyl)pyridin-1-ium--iodide (1/1) |
| Molecular Weight: | 422.35 |
| Molecular Formula: | C20 H27 N2 |
| Salt: | I- |
| Smiles: | CC(C)CC[n+]1ccccc1/C=C/c1ccc(cc1)N(C)C |
| Stereo: | ACHIRAL |
| logP: | 4.9042 |
| logD: | 4.9041 |
| logSw: | -4.4162 |
| Polar surface area: | 4.0735 |
| InChI Key: | ZHDVXQGSDBZJAD-UHFFFAOYSA-N |