ethyl 5-hydroxy-3-(3-methylbutyl)-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazole-1-carboxylate
Chemical Structure Depiction of
ethyl 5-hydroxy-3-(3-methylbutyl)-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazole-1-carboxylate
ethyl 5-hydroxy-3-(3-methylbutyl)-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazole-1-carboxylate
Compound characteristics
| Compound ID: | 5859-0223 |
| Compound Name: | ethyl 5-hydroxy-3-(3-methylbutyl)-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazole-1-carboxylate |
| Molecular Weight: | 296.29 |
| Molecular Formula: | C12 H19 F3 N2 O3 |
| Smiles: | CCOC(N1C(CC(CCC(C)C)=N1)(C(F)(F)F)O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0597 |
| logD: | 3.0597 |
| logSw: | -2.9888 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.017 |
| InChI Key: | UTOUIJCLPVCEHR-NSHDSACASA-N |