HuagongsheHuagongshe Chemistry Print Report · For research reference only
5-(4-Iodophenoxy)benzo[d][1,3]dioxole
![5-(4-Iodophenoxy)benzo[d][1,3]dioxole molecular structure](/img/chemical/71283446.png)
Identifiers & Physical Properties
| Molecular formula | C13H9IO3 |
|---|---|
| Average molar mass | 340.11 g/mol |
| Monoisotopic mass | 339.95964 g/mol |
| SMILES | Ic1ccc(Oc2ccc3c(c2)OCO3)cc1 |
| InChIKey | RKCOJTQVJCBHRO-UHFFFAOYSA-N |
| PubChem CID | 71283446 |
Chemical & Physical Properties
| XLogP | 3.8 |
|---|---|
| Topological polar surface area | 27.7 |
| Hydrogen bond donors | 0 |
| Hydrogen bond acceptors | 3 |
| Rotatable bonds | 2 |
| Heavy atoms | 17 |
| Formal charge | 0 |
| Complexity | 253 |