Base information
| Cat. No. | |
| CAS No. | 173692-85-8 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C5H6N4 |
| Molecular Weight | 122.128 |
| Exact Mass | 122.059 |
| XLogP3 | 0.19178 |
| Mr | 30.647 |
| PSA | 54.5 |
| Sequence | - |
| Atom number | 15 |
| Bond number | 15 |
| Ring number | 1 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | N#CCCn1cnnc1 |
