1-[5-tert-butyl-5-hydroxy-3-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-phenylethan-1-one
Chemical Structure Depiction of
1-[5-tert-butyl-5-hydroxy-3-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-phenylethan-1-one
1-[5-tert-butyl-5-hydroxy-3-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-phenylethan-1-one
Compound characteristics
| Compound ID: | 4607-1380 |
| Compound Name: | 1-[5-tert-butyl-5-hydroxy-3-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-phenylethan-1-one |
| Molecular Weight: | 328.33 |
| Molecular Formula: | C16 H19 F3 N2 O2 |
| Smiles: | CC(C)(C)C1(CC(C(F)(F)F)=NN1C(Cc1ccccc1)=O)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2397 |
| logD: | 3.2397 |
| logSw: | -3.2063 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.262 |
| InChI Key: | ZZSKFIJMHCUPDS-HNNXBMFYSA-N |