4-chloro-1-methyl-1H-pyrazole-5-carboxylic acid
Chemical Structure Depiction of
4-chloro-1-methyl-1H-pyrazole-5-carboxylic acid
4-chloro-1-methyl-1H-pyrazole-5-carboxylic acid
Compound characteristics
| Compound ID: | Y501-6243 |
| Compound Name: | 4-chloro-1-methyl-1H-pyrazole-5-carboxylic acid |
| Molecular Weight: | 160.56 |
| Molecular Formula: | C5 H5 Cl N2 O2 |
| Smiles: | Cn1c(C(O)=O)c(cn1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 0.1158 |
| logD: | -4.9248 |
| logSw: | -1.4793 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.162 |
| InChI Key: | SOCMTMNWGCJGLA-UHFFFAOYSA-N |