ethyl 4-bromo-5-tert-butyl-1H-pyrazole-3-carboxylate
Chemical Structure Depiction of
ethyl 4-bromo-5-tert-butyl-1H-pyrazole-3-carboxylate
ethyl 4-bromo-5-tert-butyl-1H-pyrazole-3-carboxylate
Compound characteristics
| Compound ID: | 8018-8748 |
| Compound Name: | ethyl 4-bromo-5-tert-butyl-1H-pyrazole-3-carboxylate |
| Molecular Weight: | 275.14 |
| Molecular Formula: | C10 H15 Br N2 O2 |
| Smiles: | CCOC(c1c(c(C(C)(C)C)[nH]n1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 2.9917 |
| logD: | 2.9917 |
| logSw: | -2.9139 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.294 |
| InChI Key: | QTWJONUIFJTELY-UHFFFAOYSA-N |