Base information
| Cat. No. | |
| CAS No. | 131661-41-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C5H5N3 |
| Molecular Weight | 107.113 |
| Exact Mass | 107.048 |
| XLogP3 | 0.58978 |
| Mr | 28.2687 |
| PSA | 52.47 |
| Sequence | - |
| Atom number | 13 |
| Bond number | 13 |
| Ring number | 1 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | Cc1n[nH]cc1C#N |
