HuagongsheHuagongshe Chemistry Print Report · For research reference only
4-Methyl-5-nitrosaccharin

Identifiers & Physical Properties
| Molecular formula | C8H6N2O5S |
|---|---|
| Average molar mass | 242.21 g/mol |
| SMILES | Cc1c([N+](=O)[O-])ccc2c1C(=O)NS2(=O)=O |
| InChIKey | OSNBNSASIYTIJU-UHFFFAOYSA-N |
| PubChem CID | 15334534 |
Chemical & Physical Properties
| XLogP | 0.6 |
|---|---|
| Topological polar surface area | 117 |
| Hydrogen bond donors | 1 |
| Hydrogen bond acceptors | 5 |
| Rotatable bonds | 0 |
| Heavy atoms | 16 |
| Formal charge | 0 |
| Complexity | 434 |