tert-butyl [3-nitro-1-(2,2,2-trifluoroethyl)-1H-pyrazol-4-yl]carbamate
Chemical Structure Depiction of
tert-butyl [3-nitro-1-(2,2,2-trifluoroethyl)-1H-pyrazol-4-yl]carbamate
tert-butyl [3-nitro-1-(2,2,2-trifluoroethyl)-1H-pyrazol-4-yl]carbamate
Compound characteristics
| Compound ID: | Y507-6012 |
| Compound Name: | tert-butyl [3-nitro-1-(2,2,2-trifluoroethyl)-1H-pyrazol-4-yl]carbamate |
| Molecular Weight: | 310.23 |
| Molecular Formula: | C10 H13 F3 N4 O4 |
| Smiles: | CC(C)(C)OC(Nc1cn(CC(F)(F)F)nc1[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3938 |
| logD: | 1.4342 |
| logSw: | -2.6089 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.962 |
| InChI Key: | CXVOSVZXJNOINO-UHFFFAOYSA-N |