Base information
| Cat. No. | |
| CAS No. | 118-87-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C12H11N3O5S |
| Molecular Weight | 309.298 |
| Exact Mass | 309.042 |
| XLogP3 | 4.4255 |
| Mr | 79.0709 |
| PSA | 146.62 |
| Sequence | - |
| Atom number | 32 |
| Bond number | 33 |
| Ring number | 2 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | Nc1ccc(c(c1)S(=O)(=O)O)Nc1ccc(cc1)[N+](=O)[O-] |
