Base information
| Cat. No. | |
| CAS No. | 80912-09-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C5H9N3 |
| Molecular Weight | 111.145 |
| Exact Mass | 111.08 |
| XLogP3 | 0.8919 |
| Mr | 32.8594 |
| PSA | 43.84 |
| Sequence | - |
| Atom number | 17 |
| Bond number | 17 |
| Ring number | 1 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | Cn1c(C)ncc1N |
