3,5,5'-trimethyl-4'-nitro-2'H-1,3'-bipyrazole
Chemical Structure Depiction of
3,5,5'-trimethyl-4'-nitro-2'H-1,3'-bipyrazole
3,5,5'-trimethyl-4'-nitro-2'H-1,3'-bipyrazole
Compound characteristics
| Compound ID: | 1306-0131 |
| Compound Name: | 3,5,5'-trimethyl-4'-nitro-2'H-1,3'-bipyrazole |
| Molecular Weight: | 221.22 |
| Molecular Formula: | C9 H11 N5 O2 |
| Smiles: | Cc1cc(C)n(c2c(c(C)n[nH]2)[N+]([O-])=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 0.9358 |
| logD: | 0.931 |
| logSw: | -1.7296 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.161 |
| InChI Key: | FDXAMFDRAQZQOH-UHFFFAOYSA-N |