HuagongsheHuagongshe Chemistry Print Report · For research reference only
Ethyl 3-bromo-2-hydroxy-6-methylbenzoate
Identifiers & Physical Properties
| Molecular formula | C10H11BrO3 |
|---|---|
| Average molar mass | 259.1 g/mol |
| Monoisotopic mass | 257.98916 g/mol |
| SMILES | CCOC(=O)c1c(C)ccc(Br)c1O |
| InChIKey | RMLHHHHKUVRZTQ-UHFFFAOYSA-N |
| PubChem CID | 11470920 |
Chemical & Physical Properties
| XLogP | 3.4 |
|---|---|
| Topological polar surface area | 46.5 |
| Hydrogen bond donors | 1 |
| Hydrogen bond acceptors | 3 |
| Rotatable bonds | 3 |
| Heavy atoms | 14 |
| Formal charge | 0 |
| Complexity | 208 |