Base information
| Cat. No. | |
| CAS No. | 3622-35-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H5NO2S |
| Molecular Weight | 179.196 |
| Exact Mass | 179.004 |
| XLogP3 | 1.9945 |
| Mr | 46.5793 |
| PSA | 78.43 |
| Sequence | - |
| Atom number | 17 |
| Bond number | 18 |
| Ring number | 2 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | OC(=O)c1ccc2c(c1)scn2 |
