Base information
| Cat. No. | |
| CAS No. | 144163-97-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C11H8N2O5S |
| Molecular Weight | 280.257 |
| Exact Mass | 280.015 |
| XLogP3 | 3.2901 |
| Mr | 68.396 |
| PSA | 122.48 |
| Sequence | - |
| Atom number | 27 |
| Bond number | 28 |
| Ring number | 2 |
| Rotor number | 6 |
| Residues number | 0 |
| Canonical smiles | O=C(Oc1ccc(cc1)[N+](=O)[O-])OCc1cncs1 |
