4-methyl-3-nitrobenzoic acid
Chemical Structure Depiction of
4-methyl-3-nitrobenzoic acid
4-methyl-3-nitrobenzoic acid
Compound characteristics
| Compound ID: | 0781-2248 |
| Compound Name: | 4-methyl-3-nitrobenzoic acid |
| Molecular Weight: | 181.14 |
| Molecular Formula: | C8 H7 N O4 |
| Smiles: | Cc1ccc(cc1[N+]([O-])=O)C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3611 |
| logD: | -1.0356 |
| logSw: | -2.3295 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.727 |
| InChI Key: | BBEWSMNRCUXQRF-UHFFFAOYSA-N |