1-benzyl-3-(difluoromethyl)-1H-pyrazole-4-carboxylic acid
Chemical Structure Depiction of
1-benzyl-3-(difluoromethyl)-1H-pyrazole-4-carboxylic acid
1-benzyl-3-(difluoromethyl)-1H-pyrazole-4-carboxylic acid
Compound characteristics
| Compound ID: | Y507-1256 |
| Compound Name: | 1-benzyl-3-(difluoromethyl)-1H-pyrazole-4-carboxylic acid |
| Molecular Weight: | 252.22 |
| Molecular Formula: | C12 H10 F2 N2 O2 |
| Smiles: | C(c1ccccc1)n1cc(C(O)=O)c(C(F)F)n1 |
| Stereo: | ACHIRAL |
| logP: | 2.201 |
| logD: | -0.9759 |
| logSw: | -2.5045 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.699 |
| InChI Key: | GOIRVTOSBFAJHT-UHFFFAOYSA-N |