HuagongsheHuagongshe Chemistry Print Report · For research reference only
(3R)-6-bromo-3-methyl-3,4-dihydro-1H-isochromen-1-one
Identifiers & Physical Properties
| Molecular formula | C10H9BrO2 |
|---|---|
| Average molar mass | 241.08 g/mol |
| SMILES | C[C@@H]1Cc2cc(Br)ccc2C(=O)O1 |
| InChIKey | FQXNEJZEPHQHEK-ZCFIWIBFSA-N |
| PubChem CID | 71270763 |
Chemical & Physical Properties
| XLogP | 2.9 |
|---|---|
| Topological polar surface area | 26.3 |
| Hydrogen bond donors | 0 |
| Hydrogen bond acceptors | 2 |
| Rotatable bonds | 0 |
| Heavy atoms | 13 |
| Formal charge | 0 |
| Complexity | 217 |