tert-butyl 1-methyl-3-nitro-1H-pyrazole-5-carboxylate
Chemical Structure Depiction of
tert-butyl 1-methyl-3-nitro-1H-pyrazole-5-carboxylate
tert-butyl 1-methyl-3-nitro-1H-pyrazole-5-carboxylate
Compound characteristics
| Compound ID: | Y507-5156 |
| Compound Name: | tert-butyl 1-methyl-3-nitro-1H-pyrazole-5-carboxylate |
| Molecular Weight: | 227.22 |
| Molecular Formula: | C9 H13 N3 O4 |
| Smiles: | CC(C)(C)OC(c1cc(nn1C)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.4275 |
| logD: | 1.4275 |
| logSw: | -1.5773 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 66.463 |
| InChI Key: | HQVQCBNZYDEXMX-UHFFFAOYSA-N |