HuagongsheHuagongshe Chemistry Print Report · For research reference only
3-Chloromethyl-5-cyanomethyl-1,2,4-oxadiazole

Identifiers & Physical Properties
| Molecular formula | C5H4ClN3O |
|---|---|
| Average molar mass | 157.56 g/mol |
| SMILES | N#CCc1nc(CCl)no1 |
| InChIKey | CGVIPCTWCQEGIY-UHFFFAOYSA-N |
| PubChem CID | 20161213 |
Chemical & Physical Properties
| XLogP | 0.3 |
|---|---|
| Topological polar surface area | 62.7 |
| Hydrogen bond donors | 0 |
| Hydrogen bond acceptors | 4 |
| Rotatable bonds | 2 |
| Heavy atoms | 10 |
| Formal charge | 0 |
| Complexity | 154 |