HuagongsheHuagongshe Chemistry Print Report · For research reference only
2-Chlorophenyl-(2-pyrimidinyl)acetonitrile

Identifiers & Physical Properties
| Molecular formula | C12H8ClN3 |
|---|---|
| Average molar mass | 229.66 g/mol |
| SMILES | N#CC(c1ncccn1)c1ccccc1Cl |
| InChIKey | ZAICQJHRVHLVEY-UHFFFAOYSA-N |
| PubChem CID | 12372968 |
Chemical & Physical Properties
| XLogP | 2.2 |
|---|---|
| Topological polar surface area | 49.6 |
| Hydrogen bond donors | 0 |
| Hydrogen bond acceptors | 3 |
| Rotatable bonds | 2 |
| Heavy atoms | 16 |
| Formal charge | 0 |
| Complexity | 267 |