Base information
| Cat. No. | |
| CAS No. | 252638-01-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C14H11N7O2 |
| Molecular Weight | 309.283 |
| Exact Mass | 309.097 |
| XLogP3 | 1.08216 |
| Mr | 77.4317 |
| PSA | 110.63 |
| Sequence | - |
| Atom number | 34 |
| Bond number | 35 |
| Ring number | 2 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | CC1CC(=O)OC1(N=[N+]#[N-])c1ccc(cc1)NN=C(C#N)C#N |
