1-(difluoromethyl)-3-nitro-1H-pyrazole-5-carboxylic acid
Chemical Structure Depiction of
1-(difluoromethyl)-3-nitro-1H-pyrazole-5-carboxylic acid
1-(difluoromethyl)-3-nitro-1H-pyrazole-5-carboxylic acid
Compound characteristics
| Compound ID: | Y507-0907 |
| Compound Name: | 1-(difluoromethyl)-3-nitro-1H-pyrazole-5-carboxylic acid |
| Molecular Weight: | 207.09 |
| Molecular Formula: | C5 H3 F2 N3 O4 |
| Smiles: | c1c(nn(C(F)F)c1C(O)=O)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | -0.1786 |
| logD: | -5.031 |
| logSw: | -0.8065 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.108 |
| InChI Key: | WMSRVPUDGZFSQI-UHFFFAOYSA-N |