3-bromo-1-(propan-2-yl)-1H-pyrazole-4-carboxylic acid
Chemical Structure Depiction of
3-bromo-1-(propan-2-yl)-1H-pyrazole-4-carboxylic acid
3-bromo-1-(propan-2-yl)-1H-pyrazole-4-carboxylic acid
Compound characteristics
| Compound ID: | Y507-1287 |
| Compound Name: | 3-bromo-1-(propan-2-yl)-1H-pyrazole-4-carboxylic acid |
| Molecular Weight: | 233.06 |
| Molecular Formula: | C7 H9 Br N2 O2 |
| Smiles: | CC(C)n1cc(C(O)=O)c(n1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 1.716 |
| logD: | -2.3715 |
| logSw: | -1.6312 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.505 |
| InChI Key: | FHQZDWWXIGFQSR-UHFFFAOYSA-N |