4-(2,3-dimethylanilino)-3-nitrobenzoic acid
Chemical Structure Depiction of
4-(2,3-dimethylanilino)-3-nitrobenzoic acid
4-(2,3-dimethylanilino)-3-nitrobenzoic acid
Compound characteristics
| Compound ID: | R152-0543 |
| Compound Name: | 4-(2,3-dimethylanilino)-3-nitrobenzoic acid |
| Molecular Weight: | 286.28 |
| Molecular Formula: | C15 H14 N2 O4 |
| Smiles: | Cc1cccc(c1C)Nc1ccc(cc1[N+]([O-])=O)C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8197 |
| logD: | 2.0001 |
| logSw: | -4.4261 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 69.244 |
| InChI Key: | JFKNNDGFDGRDKD-UHFFFAOYSA-N |