3-bromo-5-ethoxy-4-(2-methylpropoxy)benzoic acid
Chemical Structure Depiction of
3-bromo-5-ethoxy-4-(2-methylpropoxy)benzoic acid
3-bromo-5-ethoxy-4-(2-methylpropoxy)benzoic acid
Compound characteristics
| Compound ID: | Y507-3240 |
| Compound Name: | 3-bromo-5-ethoxy-4-(2-methylpropoxy)benzoic acid |
| Molecular Weight: | 317.18 |
| Molecular Formula: | C13 H17 Br O4 |
| Smiles: | CCOc1cc(cc(c1OCC(C)C)[Br])C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2491 |
| logD: | 2.0759 |
| logSw: | -4.0488 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.529 |
| InChI Key: | CARBXQOFVILFDV-UHFFFAOYSA-N |