N-(4-hydroxybutyl)-3-nitrobenzamide
Chemical Structure Depiction of
N-(4-hydroxybutyl)-3-nitrobenzamide
N-(4-hydroxybutyl)-3-nitrobenzamide
Compound characteristics
| Compound ID: | Y031-7698 |
| Compound Name: | N-(4-hydroxybutyl)-3-nitrobenzamide |
| Molecular Weight: | 238.24 |
| Molecular Formula: | C11 H14 N2 O4 |
| Smiles: | C(CCO)CNC(c1cccc(c1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.5981 |
| logD: | 0.5981 |
| logSw: | -2.0718 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.802 |
| InChI Key: | VNMZWNCKOACTBK-UHFFFAOYSA-N |