3-methyl-1-(3,3,3-trifluoropropyl)-1H-pyrazole-4-carboxylic acid
Chemical Structure Depiction of
3-methyl-1-(3,3,3-trifluoropropyl)-1H-pyrazole-4-carboxylic acid
3-methyl-1-(3,3,3-trifluoropropyl)-1H-pyrazole-4-carboxylic acid
Compound characteristics
| Compound ID: | Y507-1201 |
| Compound Name: | 3-methyl-1-(3,3,3-trifluoropropyl)-1H-pyrazole-4-carboxylic acid |
| Molecular Weight: | 222.16 |
| Molecular Formula: | C8 H9 F3 N2 O2 |
| Smiles: | Cc1c(cn(CCC(F)(F)F)n1)C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.2852 |
| logD: | -1.828 |
| logSw: | -1.58 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.755 |
| InChI Key: | KDKIMSFWRBCLTJ-UHFFFAOYSA-N |