3-bromo-1,5-dimethyl-1H-pyrazole-4-carboxylic acid
Chemical Structure Depiction of
3-bromo-1,5-dimethyl-1H-pyrazole-4-carboxylic acid
3-bromo-1,5-dimethyl-1H-pyrazole-4-carboxylic acid
Compound characteristics
| Compound ID: | Y507-5370 |
| Compound Name: | 3-bromo-1,5-dimethyl-1H-pyrazole-4-carboxylic acid |
| Molecular Weight: | 219.03 |
| Molecular Formula: | C6 H7 Br N2 O2 |
| Smiles: | Cc1c(C(O)=O)c(nn1C)[Br] |
| Stereo: | ACHIRAL |
| logP: | 0.6616 |
| logD: | -3.4029 |
| logSw: | -0.0812 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.03 |
| InChI Key: | IXZQNNPSPLBXNJ-UHFFFAOYSA-N |