Base information
| Cat. No. | |
| CAS No. | 84211-94-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H10OS |
| Molecular Weight | 166.24 |
| Exact Mass | 166.045 |
| XLogP3 | 2.6111 |
| Mr | 48.3575 |
| PSA | 42.37 |
| Sequence | - |
| Atom number | 21 |
| Bond number | 21 |
| Ring number | 1 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | CCSc1ccc(cc1)C=O |
