HuagongsheHuagongshe Chemistry Print Report · For research reference only
4,5-Bis(4-chlorobutylsulfanyl)-1,3-dithiole-2-thione
Identifiers & Physical Properties
| CAS No. | 193148-61-7 |
|---|---|
| Molecular formula | C11H16Cl2S5 |
| Average molar mass | 379.5 g/mol |
| Monoisotopic mass | 377.9232618 g/mol |
| SMILES | S=c1sc(SCCCCCl)c(SCCCCCl)s1 |
| InChIKey | WGAUOBIKJOFEKR-UHFFFAOYSA-N |
| PubChem CID | 10691139 |
| DTXSID | DTXSID201230173 |
Chemical & Physical Properties
| XLogP | 6 |
|---|---|
| Topological polar surface area | 133 |
| Hydrogen bond donors | 0 |
| Hydrogen bond acceptors | 5 |
| Rotatable bonds | 10 |
| Heavy atoms | 18 |
| Formal charge | 0 |
| Complexity | 267 |