HuagongsheHuagongshe Chemistry Print Report · For research reference only
3-(3-Iodo-phenylamino)-propionitrile
Identifiers & Physical Properties
| Molecular formula | C9H9IN2 |
|---|---|
| Average molar mass | 272.09 g/mol |
| SMILES | N#CCCNc1cccc(I)c1 |
| InChIKey | OSWBKOALNLPAHY-UHFFFAOYSA-N |
| PubChem CID | 19081634 |
Chemical & Physical Properties
| XLogP | 2.8 |
|---|---|
| Topological polar surface area | 35.8 |
| Hydrogen bond donors | 1 |
| Hydrogen bond acceptors | 2 |
| Rotatable bonds | 3 |
| Heavy atoms | 12 |
| Formal charge | 0 |
| Complexity | 173 |