HuagongsheHuagongshe Chemistry Print Report · For research reference only
6-Methoxypyrazin-2(1H)-one
6-Methoxypyrazin-2(1H)-one · 2-hydroxy-6-methoxypyrazine · 2(1H)-Pyrazinone, 6-methoxy-
Identifiers & Physical Properties
| CAS No. | 4774-17-8 |
|---|---|
| Molecular formula | C5H6N2O2 |
| Average molar mass | 126.11 g/mol |
| Monoisotopic mass | 126.04292744 g/mol |
| SMILES | COc1cncc(=O)[nH]1 |
| InChIKey | PJASVKBBHBEVPH-UHFFFAOYSA-N |
| PubChem CID | 19082011 |
| DTXSID | DTXSID30597892 |
Chemical & Physical Properties
| XLogP | -0.5 |
|---|---|
| Topological polar surface area | 50.7 |
| Hydrogen bond donors | 1 |
| Hydrogen bond acceptors | 3 |
| Rotatable bonds | 1 |
| Heavy atoms | 9 |
| Formal charge | 0 |
| Complexity | 183 |
| Storage conditions | 2-8°C |