3-nitro-1H-pyrazole-4-carbonitrile
Chemical Structure Depiction of
3-nitro-1H-pyrazole-4-carbonitrile
3-nitro-1H-pyrazole-4-carbonitrile
Compound characteristics
| Compound ID: | 8006-8645 |
| Compound Name: | 3-nitro-1H-pyrazole-4-carbonitrile |
| Molecular Weight: | 138.08 |
| Molecular Formula: | C4 H2 N4 O2 |
| Smiles: | C(c1c[nH]nc1[N+]([O-])=O)#N |
| Stereo: | ACHIRAL |
| logP: | 0.1692 |
| logD: | -1.0413 |
| logSw: | -1.6469 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.3 |
| InChI Key: | BHWGVDFLAUBWLA-UHFFFAOYSA-N |