2-(3-hydroxypiperidin-1-yl)-3-nitrobenzoic acid
Chemical Structure Depiction of
2-(3-hydroxypiperidin-1-yl)-3-nitrobenzoic acid
2-(3-hydroxypiperidin-1-yl)-3-nitrobenzoic acid
Compound characteristics
| Compound ID: | 8020-0059 |
| Compound Name: | 2-(3-hydroxypiperidin-1-yl)-3-nitrobenzoic acid |
| Molecular Weight: | 266.25 |
| Molecular Formula: | C12 H14 N2 O5 |
| Smiles: | C1CC(CN(C1)c1c(cccc1[N+]([O-])=O)C(O)=O)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.2751 |
| logD: | -1.9036 |
| logSw: | -2.1328 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.233 |
| InChI Key: | BWCOOSUVLBNQHD-QMMMGPOBSA-N |