1-[(2-methylphenyl)methyl]-3-(trifluoromethyl)-1H-pyrazole-5-carboxylic acid
Chemical Structure Depiction of
1-[(2-methylphenyl)methyl]-3-(trifluoromethyl)-1H-pyrazole-5-carboxylic acid
1-[(2-methylphenyl)methyl]-3-(trifluoromethyl)-1H-pyrazole-5-carboxylic acid
Compound characteristics
| Compound ID: | Y507-1218 |
| Compound Name: | 1-[(2-methylphenyl)methyl]-3-(trifluoromethyl)-1H-pyrazole-5-carboxylic acid |
| Molecular Weight: | 284.24 |
| Molecular Formula: | C13 H11 F3 N2 O2 |
| Smiles: | Cc1ccccc1Cn1c(cc(C(F)(F)F)n1)C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9942 |
| logD: | -0.6439 |
| logSw: | -2.9336 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.605 |
| InChI Key: | GWWMYEJRVWXPNQ-UHFFFAOYSA-N |