HuagongsheHuagongshe Chemistry Print Report · For research reference only
1-Iodo-2-[(methylthio)methyl]-benzene
![1-Iodo-2-[(methylthio)methyl]-benzene molecular structure](/img/chemical/10061336.png)
Identifiers & Physical Properties
| Molecular formula | C8H9IS |
|---|---|
| Average molar mass | 264.13 g/mol |
| SMILES | CSCc1ccccc1I |
| InChIKey | NOPHGRWHUDXDOK-UHFFFAOYSA-N |
| PubChem CID | 10061336 |
Chemical & Physical Properties
| XLogP | 3.3 |
|---|---|
| Topological polar surface area | 25.3 |
| Hydrogen bond donors | 0 |
| Hydrogen bond acceptors | 1 |
| Rotatable bonds | 2 |
| Heavy atoms | 10 |
| Formal charge | 0 |
| Complexity | 95.3 |