ethyl 1-(hydroxymethyl)-3-(trifluoromethyl)-1H-pyrazole-4-carboxylate
Chemical Structure Depiction of
ethyl 1-(hydroxymethyl)-3-(trifluoromethyl)-1H-pyrazole-4-carboxylate
ethyl 1-(hydroxymethyl)-3-(trifluoromethyl)-1H-pyrazole-4-carboxylate
Compound characteristics
| Compound ID: | Y507-5422 |
| Compound Name: | ethyl 1-(hydroxymethyl)-3-(trifluoromethyl)-1H-pyrazole-4-carboxylate |
| Molecular Weight: | 238.16 |
| Molecular Formula: | C8 H9 F3 N2 O3 |
| Smiles: | CCOC(c1cn(CO)nc1C(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 1.0586 |
| logD: | 1.0586 |
| logSw: | -1.3003 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.339 |
| InChI Key: | AGRNJNXPEHSAKV-UHFFFAOYSA-N |