methyl 4-bromo-1-(hydroxymethyl)-1H-pyrazole-3-carboxylate
Chemical Structure Depiction of
methyl 4-bromo-1-(hydroxymethyl)-1H-pyrazole-3-carboxylate
methyl 4-bromo-1-(hydroxymethyl)-1H-pyrazole-3-carboxylate
Compound characteristics
| Compound ID: | Y507-5430 |
| Compound Name: | methyl 4-bromo-1-(hydroxymethyl)-1H-pyrazole-3-carboxylate |
| Molecular Weight: | 235.03 |
| Molecular Formula: | C6 H7 Br N2 O3 |
| Smiles: | COC(c1c(cn(CO)n1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 0.3071 |
| logD: | 0.3071 |
| logSw: | -0.2216 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.759 |
| InChI Key: | JZMVZVXAUWXJFV-UHFFFAOYSA-N |