Base information
| Cat. No. | |
| CAS No. | 64399-24-2 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H7NO4S |
| Molecular Weight | 213.21 |
| Exact Mass | 213.01 |
| XLogP3 | 2.5381 |
| Mr | 53.9443 |
| PSA | 108.42 |
| Sequence | - |
| Atom number | 21 |
| Bond number | 21 |
| Ring number | 1 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | CSc1ccc(cc1[N+](=O)[O-])C(=O)O |
