1-[5-methyl-3-(trifluoromethyl)-1H-pyrazol-4-yl]ethan-1-one
Chemical Structure Depiction of
1-[5-methyl-3-(trifluoromethyl)-1H-pyrazol-4-yl]ethan-1-one
1-[5-methyl-3-(trifluoromethyl)-1H-pyrazol-4-yl]ethan-1-one
Compound characteristics
| Compound ID: | 8004-9513 |
| Compound Name: | 1-[5-methyl-3-(trifluoromethyl)-1H-pyrazol-4-yl]ethan-1-one |
| Molecular Weight: | 192.14 |
| Molecular Formula: | C7 H7 F3 N2 O |
| Smiles: | CC(c1c(C(F)(F)F)n[nH]c1C)=O |
| Stereo: | ACHIRAL |
| logP: | 1.2684 |
| logD: | 0.9911 |
| logSw: | -1.2487 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 38.174 |
| InChI Key: | ZIEZFONSWLOQBN-UHFFFAOYSA-N |