4-iodo-1-(2-methylpropyl)-1H-pyrazole-5-carboxylic acid
Chemical Structure Depiction of
4-iodo-1-(2-methylpropyl)-1H-pyrazole-5-carboxylic acid
4-iodo-1-(2-methylpropyl)-1H-pyrazole-5-carboxylic acid
Compound characteristics
| Compound ID: | Y507-1182 |
| Compound Name: | 4-iodo-1-(2-methylpropyl)-1H-pyrazole-5-carboxylic acid |
| Molecular Weight: | 294.09 |
| Molecular Formula: | C8 H11 I N2 O2 |
| Smiles: | CC(C)Cn1c(C(O)=O)c(cn1)I |
| Stereo: | ACHIRAL |
| logP: | 1.728 |
| logD: | -2.427 |
| logSw: | -1.5241 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.876 |
| InChI Key: | XAPTXGYUOXQRLA-UHFFFAOYSA-N |