1-tert-butyl-1H-pyrazole-4-carboxylic acid
Chemical Structure Depiction of
1-tert-butyl-1H-pyrazole-4-carboxylic acid
1-tert-butyl-1H-pyrazole-4-carboxylic acid
Compound characteristics
| Compound ID: | Y507-1419 |
| Compound Name: | 1-tert-butyl-1H-pyrazole-4-carboxylic acid |
| Molecular Weight: | 168.19 |
| Molecular Formula: | C8 H12 N2 O2 |
| Smiles: | CC(C)(C)n1cc(cn1)C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.2218 |
| logD: | -1.9143 |
| logSw: | -1.1275 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.971 |
| InChI Key: | UQRFFZHSJYVBMX-UHFFFAOYSA-N |