Base information
| Cat. No. | |
| CAS No. | 21512-16-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C6H3NOS |
| Molecular Weight | 137.159 |
| Exact Mass | 136.994 |
| XLogP3 | 1.43228 |
| Mr | 34.4215 |
| PSA | 69.1 |
| Sequence | - |
| Atom number | 12 |
| Bond number | 12 |
| Ring number | 1 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | O=Cc1ccc(s1)C#N |
