Base information
| Cat. No. | |
| CAS No. | 6639-36-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C12H7NO2S |
| Molecular Weight | 229.254 |
| Exact Mass | 229.02 |
| XLogP3 | 4.4859 |
| Mr | 68.153 |
| PSA | 74.06 |
| Sequence | - |
| Atom number | 23 |
| Bond number | 25 |
| Ring number | 3 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | [O-][N+](=O)c1ccc2c(c1)c1ccccc1s2 |
