Base information
| Cat. No. | |
| CAS No. | 42590-97-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H9NOS |
| Molecular Weight | 167.228 |
| Exact Mass | 167.04 |
| XLogP3 | 2.0297 |
| Mr | 48.3984 |
| PSA | 67.34 |
| Sequence | - |
| Atom number | 20 |
| Bond number | 20 |
| Ring number | 1 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | COc1ccccc1C(=S)N |
