4-[(2-hydroxyethyl)amino]-3-nitrobenzoic acid
Chemical Structure Depiction of
4-[(2-hydroxyethyl)amino]-3-nitrobenzoic acid
4-[(2-hydroxyethyl)amino]-3-nitrobenzoic acid
Compound characteristics
| Compound ID: | 0082-0027 |
| Compound Name: | 4-[(2-hydroxyethyl)amino]-3-nitrobenzoic acid |
| Molecular Weight: | 226.19 |
| Molecular Formula: | C9 H10 N2 O5 |
| Smiles: | C(CO)Nc1ccc(cc1[N+]([O-])=O)C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.2813 |
| logD: | -1.5383 |
| logSw: | -2.0082 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 88.033 |
| InChI Key: | KRTQQHYYZBCHED-UHFFFAOYSA-N |