tert-butyl (3-nitro-1H-pyrazol-1-yl)acetate
Chemical Structure Depiction of
tert-butyl (3-nitro-1H-pyrazol-1-yl)acetate
tert-butyl (3-nitro-1H-pyrazol-1-yl)acetate
Compound characteristics
| Compound ID: | Y507-5106 |
| Compound Name: | tert-butyl (3-nitro-1H-pyrazol-1-yl)acetate |
| Molecular Weight: | 227.22 |
| Molecular Formula: | C9 H13 N3 O4 |
| Smiles: | CC(C)(C)OC(Cn1ccc(n1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.0938 |
| logD: | 1.0938 |
| logSw: | -1.986 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 67.012 |
| InChI Key: | YSHGVIXDDTXRJC-UHFFFAOYSA-N |