Base information
| Cat. No. | |
| CAS No. | 31770-95-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H6N2O6S |
| Molecular Weight | 258.208 |
| Exact Mass | 257.995 |
| XLogP3 | 2.0368 |
| Mr | 58.7507 |
| PSA | 134.34 |
| Sequence | - |
| Atom number | 23 |
| Bond number | 24 |
| Ring number | 2 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | O=c1[nH]c2c(o1)cc(c(c2)S(=O)(=O)C)[N+](=O)[O-] |
