C5H2Cl3NO — CID 16076
Pyriclor (PubChem CID 16076) has the molecular formula C5H2Cl3NO and a molecular weight of 198.43 g/mol. Its IUPAC name is 2,3,5-trichloro-1H-pyridin-4-one.
| Compound Name | Pyriclor |
|---|---|
| PubChem CID | 16076 |
| Molecular Formula | C5H2Cl3NO |
| Molecular Weight | 198.43 g/mol |
| Exact Mass | 196.92 |
| IUPAC Name | 2,3,5-trichloro-1H-pyridin-4-one |
| SMILES | C1=C(C(=O)C(=C(N1)Cl)Cl)Cl |
| InChIKey | XTVIFVALDYTCLL-UHFFFAOYSA-N |
| XLogP | 2.70 |
| TPSA | 29.10 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Heavy Atoms | 10 |
| Complexity | 243 |
Passes Rule of Five
| Rule | Value |
|---|---|
| MW ≤ 500 | 198.43 |
| LogP ≤ 5 | 2.70 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
| Structural Alerts | {'alert_name': '2-halo_pyridine', 'substructure': 'N/A'} |
|---|