1-benzyl-5-(trifluoromethyl)-1H-pyrazole-3-carboxylic acid
Chemical Structure Depiction of
1-benzyl-5-(trifluoromethyl)-1H-pyrazole-3-carboxylic acid
1-benzyl-5-(trifluoromethyl)-1H-pyrazole-3-carboxylic acid
Compound characteristics
| Compound ID: | Y507-1457 |
| Compound Name: | 1-benzyl-5-(trifluoromethyl)-1H-pyrazole-3-carboxylic acid |
| Molecular Weight: | 270.21 |
| Molecular Formula: | C12 H9 F3 N2 O2 |
| Smiles: | C(c1ccccc1)n1c(cc(C(O)=O)n1)C(F)(F)F |
| Stereo: | ACHIRAL |
| logP: | 2.2032 |
| logD: | -0.0103 |
| logSw: | -2.3757 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.605 |
| InChI Key: | LHBBRDASVFAZKV-UHFFFAOYSA-N |