HuagongsheHuagongshe Chemistry Print Report · For research reference only
2-Iodo-3-(4-methoxyphenoxy)benzo[b]thiophene
![2-Iodo-3-(4-methoxyphenoxy)benzo[b]thiophene molecular structure](/img/chemical/10691279.png)
Identifiers & Physical Properties
| Molecular formula | C15H11IO2S |
|---|---|
| Average molar mass | 382.2 g/mol |
| Monoisotopic mass | 381.95245 g/mol |
| SMILES | COc1ccc(Oc2c(I)sc3ccccc23)cc1 |
| InChIKey | IXJYTCPCLHVGNN-UHFFFAOYSA-N |
| PubChem CID | 10691279 |
Chemical & Physical Properties
| XLogP | 5.1 |
|---|---|
| Topological polar surface area | 46.7 |
| Hydrogen bond donors | 0 |
| Hydrogen bond acceptors | 3 |
| Rotatable bonds | 3 |
| Heavy atoms | 19 |
| Formal charge | 0 |
| Complexity | 294 |