Base information
| Cat. No. | |
| CAS No. | 52685-70-8 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H8N4 |
| Molecular Weight | 160.176 |
| Exact Mass | 160.075 |
| XLogP3 | 1.27646 |
| Mr | 42.5977 |
| PSA | 76.26 |
| Sequence | - |
| Atom number | 20 |
| Bond number | 20 |
| Ring number | 1 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | N#Cc1[nH]c(nc1C#N)C(C)C |
