3-(4-methylquinolin-1-ium-1-yl)propane-1-sulfonate
Chemical Structure Depiction of
3-(4-methylquinolin-1-ium-1-yl)propane-1-sulfonate
3-(4-methylquinolin-1-ium-1-yl)propane-1-sulfonate
Compound characteristics
| Compound ID: | 0082-0024 |
| Compound Name: | 3-(4-methylquinolin-1-ium-1-yl)propane-1-sulfonate |
| Molecular Weight: | 265.33 |
| Molecular Formula: | C13 H15 N O3 S |
| Smiles: | Cc1cc[n+](CCCS([O-])(=O)=O)c2ccccc12 |
| Stereo: | ACHIRAL |
| logP: | 0.8039 |
| logD: | 0.8039 |
| logSw: | -1.934 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 44.368 |
| InChI Key: | QHORCTJPQGNFIZ-UHFFFAOYSA-N |