Base information
| Cat. No. | |
| CAS No. | 1195-52-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C7H6O2S |
| Molecular Weight | 154.186 |
| Exact Mass | 154.009 |
| XLogP3 | 1.8459 |
| Mr | 40.9888 |
| PSA | 65.54 |
| Sequence | - |
| Atom number | 16 |
| Bond number | 16 |
| Ring number | 1 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | OC(=O)C=Cc1cscc1 |