Base information
| Cat. No. | |
| CAS No. | 64882-52-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C5H7N3O |
| Molecular Weight | 125.129 |
| Exact Mass | 125.059 |
| XLogP3 | -0.1329 |
| Mr | 31.098 |
| PSA | 47.78 |
| Sequence | - |
| Atom number | 16 |
| Bond number | 16 |
| Ring number | 1 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | CC(=O)Cn1cncn1 |
