butyl 2-hydroxy-4,6-dimethyl-5-nitropyridine-3-carboxylate
Chemical Structure Depiction of
butyl 2-hydroxy-4,6-dimethyl-5-nitropyridine-3-carboxylate
butyl 2-hydroxy-4,6-dimethyl-5-nitropyridine-3-carboxylate
Compound characteristics
| Compound ID: | 8012-7760 |
| Compound Name: | butyl 2-hydroxy-4,6-dimethyl-5-nitropyridine-3-carboxylate |
| Molecular Weight: | 268.27 |
| Molecular Formula: | C12 H16 N2 O5 |
| Smiles: | CCCCOC(c1c(C)c(c(C)nc1O)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6637 |
| logD: | 0.7911 |
| logSw: | -2.4015 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.219 |
| InChI Key: | NSZBCBDQKDUTAG-UHFFFAOYSA-N |