Base information
| Cat. No. | |
| CAS No. | 75776-47-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C6H6N4 |
| Molecular Weight | 134.139 |
| Exact Mass | 134.059 |
| XLogP3 | 1.28008 |
| Mr | 37.7608 |
| PSA | 88.72 |
| Sequence | - |
| Atom number | 16 |
| Bond number | 16 |
| Ring number | 1 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | Nc1cc(N)ncc1C#N |
