2-[4-chloro-3-(trifluoromethyl)-1H-pyrazol-1-yl]butanoic acid
Chemical Structure Depiction of
2-[4-chloro-3-(trifluoromethyl)-1H-pyrazol-1-yl]butanoic acid
2-[4-chloro-3-(trifluoromethyl)-1H-pyrazol-1-yl]butanoic acid
Compound characteristics
| Compound ID: | Y504-8576 |
| Compound Name: | 2-[4-chloro-3-(trifluoromethyl)-1H-pyrazol-1-yl]butanoic acid |
| Molecular Weight: | 256.61 |
| Molecular Formula: | C8 H8 Cl F3 N2 O2 |
| Smiles: | CCC(C(O)=O)n1cc(c(C(F)(F)F)n1)[Cl] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.6657 |
| logD: | -1.7921 |
| logSw: | -2.2693 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.359 |
| InChI Key: | NEKKYQSMOFNZEV-YFKPBYRVSA-N |