2-hydroxy-3-(hydroxymethyl)-5-nitrobenzaldehyde
Chemical Structure Depiction of
2-hydroxy-3-(hydroxymethyl)-5-nitrobenzaldehyde
2-hydroxy-3-(hydroxymethyl)-5-nitrobenzaldehyde
Compound characteristics
| Compound ID: | 0073-0055 |
| Compound Name: | 2-hydroxy-3-(hydroxymethyl)-5-nitrobenzaldehyde |
| Molecular Weight: | 197.14 |
| Molecular Formula: | C8 H7 N O5 |
| Smiles: | [H]C(c1cc(cc(CO)c1O)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.5694 |
| logD: | -0.6791 |
| logSw: | -1.0931 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.373 |
| InChI Key: | AHNFRIWEAWXCRY-UHFFFAOYSA-N |