4-(methoxycarbonyl)-1-(2-oxo-2-phenylethyl)pyridin-1-ium--chloride (1/1)
Chemical Structure Depiction of
4-(methoxycarbonyl)-1-(2-oxo-2-phenylethyl)pyridin-1-ium--chloride (1/1)
4-(methoxycarbonyl)-1-(2-oxo-2-phenylethyl)pyridin-1-ium--chloride (1/1)
Compound characteristics
| Compound ID: | 8014-8862 |
| Compound Name: | 4-(methoxycarbonyl)-1-(2-oxo-2-phenylethyl)pyridin-1-ium--chloride (1/1) |
| Molecular Weight: | 291.73 |
| Molecular Formula: | C15 H14 N O3 |
| Salt: | Cl- |
| Smiles: | COC(c1cc[n+](CC(c2ccccc2)=O)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2573 |
| logD: | 2.2573 |
| logSw: | -2.2165 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 37.452 |
| InChI Key: | VUXGOEHUBPSSOX-UHFFFAOYSA-N |