4-(3,5-dimethylanilino)-3-nitrobenzoic acid
Chemical Structure Depiction of
4-(3,5-dimethylanilino)-3-nitrobenzoic acid
4-(3,5-dimethylanilino)-3-nitrobenzoic acid
Compound characteristics
| Compound ID: | R152-0629 |
| Compound Name: | 4-(3,5-dimethylanilino)-3-nitrobenzoic acid |
| Molecular Weight: | 286.28 |
| Molecular Formula: | C15 H14 N2 O4 |
| Smiles: | Cc1cc(C)cc(c1)Nc1ccc(cc1[N+]([O-])=O)C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6749 |
| logD: | 1.8553 |
| logSw: | -4.4112 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 69.942 |
| InChI Key: | ZKUZLWMYEVMDBA-UHFFFAOYSA-N |