N-butyl-3-nitrobenzamide
Chemical Structure Depiction of
N-butyl-3-nitrobenzamide
N-butyl-3-nitrobenzamide
Compound characteristics
| Compound ID: | Y031-7680 |
| Compound Name: | N-butyl-3-nitrobenzamide |
| Molecular Weight: | 222.24 |
| Molecular Formula: | C11 H14 N2 O3 |
| Smiles: | CCCCNC(c1cccc(c1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4452 |
| logD: | 2.4452 |
| logSw: | -2.9091 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.146 |
| InChI Key: | PLKPLRMLCSBJKV-UHFFFAOYSA-N |