1-methyl-4-nitro-1H-pyrazole-3-carboxylic acid
Chemical Structure Depiction of
1-methyl-4-nitro-1H-pyrazole-3-carboxylic acid
1-methyl-4-nitro-1H-pyrazole-3-carboxylic acid
Compound characteristics
| Compound ID: | 1794-0060 |
| Compound Name: | 1-methyl-4-nitro-1H-pyrazole-3-carboxylic acid |
| Molecular Weight: | 171.11 |
| Molecular Formula: | C5 H5 N3 O4 |
| Smiles: | Cn1cc(c(C(O)=O)n1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | -0.6561 |
| logD: | -5.5557 |
| logSw: | -0.4891 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.083 |
| InChI Key: | OMMBYRSUPXNTEK-UHFFFAOYSA-N |