HuagongsheHuagongshe Chemistry Print Report · For research reference only
1-Deoxy-1-nitro-L-glucitol

Identifiers & Physical Properties
| CAS No. | 69257-51-8 |
|---|---|
| Molecular formula | C6H13NO7 |
| Average molar mass | 211.17 g/mol |
| Monoisotopic mass | 211.06920176 g/mol |
| SMILES | O=[N+]([O-])C[C@@H](O)[C@H](O)[C@@H](O)[C@@H](O)CO |
| InChIKey | HOFCJTOUEGMYBT-VANKVMQKSA-N |
| PubChem CID | 13388317 |
| EC No. | 273-939-9 |
| DTXSID | DTXSID30219320 |
Chemical & Physical Properties
| XLogP | -3.1 |
|---|---|
| Topological polar surface area | 147 |
| Hydrogen bond donors | 5 |
| Hydrogen bond acceptors | 7 |
| Rotatable bonds | 5 |
| Heavy atoms | 14 |
| Formal charge | 0 |
| Complexity | 182 |