Base information
| Cat. No. | |
| CAS No. | 549476-61-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H10N2O4S |
| Molecular Weight | 242.252 |
| Exact Mass | 242.036 |
| XLogP3 | 3.0304 |
| Mr | 58.6597 |
| PSA | 100.37 |
| Sequence | - |
| Atom number | 26 |
| Bond number | 27 |
| Ring number | 2 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | O=S(=O)(c1ccc(cc1)[N+](=O)[O-])NC1CC1 |
