Base information
| Cat. No. | |
| CAS No. | 771565-96-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C7H3N3S |
| Molecular Weight | 161.184 |
| Exact Mass | 161.005 |
| XLogP3 | 1.57366 |
| Mr | 41.317 |
| PSA | 88.71 |
| Sequence | - |
| Atom number | 14 |
| Bond number | 14 |
| Ring number | 1 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | N#CC(=Cc1nccs1)C#N |
