Base information
| Cat. No. | |
| CAS No. | 739366-03-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C5H9N3O |
| Molecular Weight | 127.144 |
| Exact Mass | 127.075 |
| XLogP3 | 0.7195 |
| Mr | 33.8501 |
| PSA | 63.93 |
| Sequence | - |
| Atom number | 18 |
| Bond number | 18 |
| Ring number | 1 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | COCc1cc(n[nH]1)N |
