3-methyl-1-(2,2,2-trifluoroethyl)-1H-pyrazole-4-carboxylic acid
Chemical Structure Depiction of
3-methyl-1-(2,2,2-trifluoroethyl)-1H-pyrazole-4-carboxylic acid
3-methyl-1-(2,2,2-trifluoroethyl)-1H-pyrazole-4-carboxylic acid
Compound characteristics
| Compound ID: | Y507-1251 |
| Compound Name: | 3-methyl-1-(2,2,2-trifluoroethyl)-1H-pyrazole-4-carboxylic acid |
| Molecular Weight: | 208.14 |
| Molecular Formula: | C7 H7 F3 N2 O2 |
| Smiles: | Cc1c(cn(CC(F)(F)F)n1)C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.1078 |
| logD: | -2.0054 |
| logSw: | -1.5889 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.777 |
| InChI Key: | CHTJYARIOYPNAG-UHFFFAOYSA-N |