Base information
| Cat. No. | |
| CAS No. | 83019-91-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H11N3O4S |
| Molecular Weight | 245.256 |
| Exact Mass | 245.047 |
| XLogP3 | 2.527 |
| Mr | 58.6741 |
| PSA | 126.39 |
| Sequence | - |
| Atom number | 27 |
| Bond number | 27 |
| Ring number | 1 |
| Rotor number | 5 |
| Residues number | 0 |
| Canonical smiles | NCCNS(=O)(=O)c1ccccc1[N+](=O)[O-] |