1-butyl-4-iodo-1H-pyrazole-3-carboxylic acid
Chemical Structure Depiction of
1-butyl-4-iodo-1H-pyrazole-3-carboxylic acid
1-butyl-4-iodo-1H-pyrazole-3-carboxylic acid
Compound characteristics
| Compound ID: | Y507-1380 |
| Compound Name: | 1-butyl-4-iodo-1H-pyrazole-3-carboxylic acid |
| Molecular Weight: | 294.09 |
| Molecular Formula: | C8 H11 I N2 O2 |
| Smiles: | CCCCn1cc(c(C(O)=O)n1)I |
| Stereo: | ACHIRAL |
| logP: | 1.6851 |
| logD: | -1.8196 |
| logSw: | -1.4952 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.949 |
| InChI Key: | NMVDYELPLYIEMF-UHFFFAOYSA-N |