3-(tert-butylsulfanyl)-4,4-bis(trifluoromethyl)-4H-pyrazole
Chemical Structure Depiction of
3-(tert-butylsulfanyl)-4,4-bis(trifluoromethyl)-4H-pyrazole
3-(tert-butylsulfanyl)-4,4-bis(trifluoromethyl)-4H-pyrazole
Compound characteristics
| Compound ID: | 8013-3336 |
| Compound Name: | 3-(tert-butylsulfanyl)-4,4-bis(trifluoromethyl)-4H-pyrazole |
| Molecular Weight: | 292.24 |
| Molecular Formula: | C9 H10 F6 N2 S |
| Smiles: | CC(C)(C)SC1C(C=NN=1)(C(F)(F)F)C(F)(F)F |
| Stereo: | ACHIRAL |
| logP: | 3.7382 |
| logD: | 3.73 |
| logSw: | -4.0025 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 21.2295 |
| InChI Key: | ZPROGTIACCYDPO-UHFFFAOYSA-N |