3-[4-chloro-3-(trifluoromethyl)-1H-pyrazol-1-yl]propanoic acid
Chemical Structure Depiction of
3-[4-chloro-3-(trifluoromethyl)-1H-pyrazol-1-yl]propanoic acid
3-[4-chloro-3-(trifluoromethyl)-1H-pyrazol-1-yl]propanoic acid
Compound characteristics
| Compound ID: | Y507-0553 |
| Compound Name: | 3-[4-chloro-3-(trifluoromethyl)-1H-pyrazol-1-yl]propanoic acid |
| Molecular Weight: | 242.58 |
| Molecular Formula: | C7 H6 Cl F3 N2 O2 |
| Smiles: | C(Cn1cc(c(C(F)(F)F)n1)[Cl])C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.6613 |
| logD: | -2.159 |
| logSw: | -1.8006 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.924 |
| InChI Key: | OFWQREWWEXRWKS-UHFFFAOYSA-N |