methyl 3-bromo-1-methyl-1H-pyrazole-4-carboxylate
Chemical Structure Depiction of
methyl 3-bromo-1-methyl-1H-pyrazole-4-carboxylate
methyl 3-bromo-1-methyl-1H-pyrazole-4-carboxylate
Compound characteristics
| Compound ID: | Y507-3993 |
| Compound Name: | methyl 3-bromo-1-methyl-1H-pyrazole-4-carboxylate |
| Molecular Weight: | 219.03 |
| Molecular Formula: | C6 H7 Br N2 O2 |
| Smiles: | Cn1cc(C(=O)OC)c(n1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 0.9441 |
| logD: | 0.9441 |
| logSw: | -1.1662 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 37.118 |
| InChI Key: | HOEMPLIQVVTQRB-UHFFFAOYSA-N |