Base information
| Cat. No. | |
| CAS No. | 28648-86-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C5H5N3O |
| Molecular Weight | 123.113 |
| Exact Mass | 123.043 |
| XLogP3 | 0.2758 |
| Mr | 30.1269 |
| PSA | 68.87 |
| Sequence | - |
| Atom number | 14 |
| Bond number | 14 |
| Ring number | 1 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | NC(=O)c1ccncn1 |
