HuagongsheHuagongshe Chemistry Print Report · For research reference only
Methyl 3-(2-bromo-3,5-difluorophenyl)propanoate
Identifiers & Physical Properties
| Molecular formula | C10H9BrF2O2 |
|---|---|
| Average molar mass | 279.08 g/mol |
| Monoisotopic mass | 277.9754 g/mol |
| SMILES | COC(=O)CCc1cc(F)cc(F)c1Br |
| InChIKey | MLYRXINCEKNWNM-UHFFFAOYSA-N |
| PubChem CID | 89826041 |
Chemical & Physical Properties
| XLogP | 2.9 |
|---|---|
| Topological polar surface area | 26.3 |
| Hydrogen bond donors | 0 |
| Hydrogen bond acceptors | 4 |
| Rotatable bonds | 4 |
| Heavy atoms | 15 |
| Formal charge | 0 |
| Complexity | 225 |