HuagongsheHuagongshe Chemistry Print Report · For research reference only
2,2'-(5-Bromo-1,3-phenylene)dithiophene

Identifiers & Physical Properties
| CAS No. | 1093728-44-9 |
|---|---|
| Molecular formula | C14H9BrS2 |
| Average molar mass | 321.3 g/mol |
| Monoisotopic mass | 319.93291 g/mol |
| SMILES | Brc1cc(-c2cccs2)cc(-c2cccs2)c1 |
| InChIKey | PIGTVIKDGDJPPH-UHFFFAOYSA-N |
| PubChem CID | 25194574 |
| DTXSID | DTXSID701268082 |
Chemical & Physical Properties
| XLogP | 5.3 |
|---|---|
| Topological polar surface area | 56.5 |
| Hydrogen bond donors | 0 |
| Hydrogen bond acceptors | 2 |
| Rotatable bonds | 2 |
| Heavy atoms | 17 |
| Formal charge | 0 |
| Complexity | 235 |