methyl 1-(hydroxymethyl)-4-iodo-1H-pyrazole-3-carboxylate
Chemical Structure Depiction of
methyl 1-(hydroxymethyl)-4-iodo-1H-pyrazole-3-carboxylate
methyl 1-(hydroxymethyl)-4-iodo-1H-pyrazole-3-carboxylate
Compound characteristics
| Compound ID: | Y507-5431 |
| Compound Name: | methyl 1-(hydroxymethyl)-4-iodo-1H-pyrazole-3-carboxylate |
| Molecular Weight: | 282.03 |
| Molecular Formula: | C6 H7 I N2 O3 |
| Smiles: | COC(c1c(cn(CO)n1)I)=O |
| Stereo: | ACHIRAL |
| logP: | 0.4811 |
| logD: | 0.4811 |
| logSw: | -0.4849 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.759 |
| InChI Key: | XJWXYAXQBNFPRH-UHFFFAOYSA-N |