Base information
| Cat. No. | |
| CAS No. | 439608-30-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H9NOS |
| Molecular Weight | 179.239 |
| Exact Mass | 179.04 |
| XLogP3 | 2.8581 |
| Mr | 50.696 |
| PSA | 51.33 |
| Sequence | - |
| Atom number | 21 |
| Bond number | 22 |
| Ring number | 2 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | CSc1nc2c(o1)ccc(c2)C |
