Base information
| Cat. No. | |
| CAS No. | 67808-64-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C7H6O3S |
| Molecular Weight | 170.186 |
| Exact Mass | 170.004 |
| XLogP3 | 1.3472 |
| Mr | 40.986 |
| PSA | 71.61 |
| Sequence | - |
| Atom number | 17 |
| Bond number | 17 |
| Ring number | 1 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | COC(=O)c1ccc(s1)C=O |
