3,4-dihydroxy-5-nitrobenzonitrile
Chemical Structure Depiction of
3,4-dihydroxy-5-nitrobenzonitrile
3,4-dihydroxy-5-nitrobenzonitrile
Compound characteristics
| Compound ID: | 8020-6585 |
| Compound Name: | 3,4-dihydroxy-5-nitrobenzonitrile |
| Molecular Weight: | 180.12 |
| Molecular Formula: | C7 H4 N2 O4 |
| Smiles: | C(c1cc(c(c(c1)O)O)[N+]([O-])=O)#N |
| Stereo: | ACHIRAL |
| logP: | 1.1092 |
| logD: | -1.7152 |
| logSw: | -1.4953 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 82.402 |
| InChI Key: | JRBDMOJXCREXNN-UHFFFAOYSA-N |