3-iodo-1-methyl-1H-pyrazole-5-carboxylic acid
Chemical Structure Depiction of
3-iodo-1-methyl-1H-pyrazole-5-carboxylic acid
3-iodo-1-methyl-1H-pyrazole-5-carboxylic acid
Compound characteristics
| Compound ID: | Y507-1416 |
| Compound Name: | 3-iodo-1-methyl-1H-pyrazole-5-carboxylic acid |
| Molecular Weight: | 252.01 |
| Molecular Formula: | C5 H5 I N2 O2 |
| Smiles: | Cn1c(cc(n1)I)C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.6399 |
| logD: | -3.9772 |
| logSw: | -0.8097 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.63 |
| InChI Key: | VVJMMQIBOKPRDS-UHFFFAOYSA-N |