Base information
| Cat. No. | |
| CAS No. | 122520-90-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C13H8N4O3 |
| Molecular Weight | 268.228 |
| Exact Mass | 268.06 |
| XLogP3 | 1.67064 |
| Mr | 68.1174 |
| PSA | 158.08 |
| Sequence | - |
| Atom number | 28 |
| Bond number | 28 |
| Ring number | 1 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | N#C/C(=C\c1cc(O)c(c(c1)O)O)/C(=C(C#N)C#N)N |
