N-(butan-2-yl)-4-methyl-3-nitrobenzamide
Chemical Structure Depiction of
N-(butan-2-yl)-4-methyl-3-nitrobenzamide
N-(butan-2-yl)-4-methyl-3-nitrobenzamide
Compound characteristics
| Compound ID: | Y503-1057 |
| Compound Name: | N-(butan-2-yl)-4-methyl-3-nitrobenzamide |
| Molecular Weight: | 236.27 |
| Molecular Formula: | C12 H16 N2 O3 |
| Smiles: | CCC(C)NC(c1ccc(C)c(c1)[N+]([O-])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.3147 |
| logD: | 2.3147 |
| logSw: | -2.6977 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.445 |
| InChI Key: | NYTBNNHPQVULBM-VIFPVBQESA-N |