4-nitro-1,2-dihydro-3H-pyrazol-3-one
Chemical Structure Depiction of
4-nitro-1,2-dihydro-3H-pyrazol-3-one
4-nitro-1,2-dihydro-3H-pyrazol-3-one
Compound characteristics
| Compound ID: | 8009-2468 |
| Compound Name: | 4-nitro-1,2-dihydro-3H-pyrazol-3-one |
| Molecular Weight: | 129.07 |
| Molecular Formula: | C3 H3 N3 O3 |
| Smiles: | C1=C(C(NN1)=O)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | -0.8209 |
| logD: | -1.6696 |
| logSw: | -1.1092 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.077 |
| InChI Key: | MUWSVFYZSADOFT-UHFFFAOYSA-N |