HuagongsheHuagongshe Chemistry Print Report · For research reference only
3-nitropyridine-2-sulfonic Acid
3-Nitropyridine-2-sulfonicaci · 3-nitro-2-pyridinesulfonic acid · 3-Nitropyridine-2-sulfonic acid · 2-Pyridinesulfonic acid, 3-nitro- · 3-NITROPYRIDINE-2-SULFONIC ACID ISO 9001:2015 REACH

Identifiers & Physical Properties
| CAS No. | 54247-50-6 |
|---|---|
| Molecular formula | C5H4N2O5S |
| Average molar mass | 204.16 g/mol |
| Monoisotopic mass | 203.98409223 g/mol |
| SMILES | O=[N+]([O-])c1cccnc1S(=O)(=O)O |
| InChIKey | WZBDCLMTYAGWKV-UHFFFAOYSA-N |
| PubChem CID | 2762801 |
| DTXSID | DTXSID90376463 |
Chemical & Physical Properties
| XLogP | -0.2 |
|---|---|
| Topological polar surface area | 121 |
| Hydrogen bond donors | 1 |
| Hydrogen bond acceptors | 6 |
| Rotatable bonds | 1 |
| Heavy atoms | 13 |
| Formal charge | 0 |
| Complexity | 289 |