N-(2-cyanoethyl)-3-nitrobenzamide
Chemical Structure Depiction of
N-(2-cyanoethyl)-3-nitrobenzamide
N-(2-cyanoethyl)-3-nitrobenzamide
Compound characteristics
| Compound ID: | 8007-3336 |
| Compound Name: | N-(2-cyanoethyl)-3-nitrobenzamide |
| Molecular Weight: | 219.2 |
| Molecular Formula: | C10 H9 N3 O3 |
| Smiles: | C(CNC(c1cccc(c1)[N+]([O-])=O)=O)C#N |
| Stereo: | ACHIRAL |
| logP: | 0.444 |
| logD: | 0.444 |
| logSw: | -2.1482 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.638 |
| InChI Key: | MWQSMDVYOFGWRA-UHFFFAOYSA-N |