4-nitro-1H-pyrazole-3,5-dicarboxylic acid
Chemical Structure Depiction of
4-nitro-1H-pyrazole-3,5-dicarboxylic acid
4-nitro-1H-pyrazole-3,5-dicarboxylic acid
Compound characteristics
| Compound ID: | K061-1139 |
| Compound Name: | 4-nitro-1H-pyrazole-3,5-dicarboxylic acid |
| Molecular Weight: | 201.09 |
| Molecular Formula: | C5 H3 N3 O6 |
| Smiles: | C(c1c(c(C(O)=O)[nH]n1)[N+]([O-])=O)(O)=O |
| Stereo: | ACHIRAL |
| logP: | -0.9683 |
| logD: | -7.1038 |
| logSw: | -0.4785 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 114.137 |
| InChI Key: | DEGBMJMGROCSHR-UHFFFAOYSA-N |