Base information
| Cat. No. | |
| CAS No. | 127798-29-2 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H8S |
| Molecular Weight | 136.214 |
| Exact Mass | 136.035 |
| XLogP3 | 2.3462 |
| Mr | 42.186 |
| PSA | 28.24 |
| Sequence | - |
| Atom number | 17 |
| Bond number | 17 |
| Ring number | 1 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | C#Cc1cc(sc1C)C |
