3-(difluoromethyl)-1-(4-nitrophenyl)-1H-pyrazole-4-carboxylic acid
Chemical Structure Depiction of
3-(difluoromethyl)-1-(4-nitrophenyl)-1H-pyrazole-4-carboxylic acid
3-(difluoromethyl)-1-(4-nitrophenyl)-1H-pyrazole-4-carboxylic acid
Compound characteristics
| Compound ID: | Y507-1323 |
| Compound Name: | 3-(difluoromethyl)-1-(4-nitrophenyl)-1H-pyrazole-4-carboxylic acid |
| Molecular Weight: | 283.19 |
| Molecular Formula: | C11 H7 F2 N3 O4 |
| Smiles: | c1cc(ccc1[N+]([O-])=O)n1cc(C(O)=O)c(C(F)F)n1 |
| Stereo: | ACHIRAL |
| logP: | 2.347 |
| logD: | -2.9202 |
| logSw: | -2.4811 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.932 |
| InChI Key: | REIQAQLUDXRDJO-UHFFFAOYSA-N |