Base information
| Cat. No. | |
| CAS No. | 2904-28-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C12H12N6O3 |
| Molecular Weight | 288.262 |
| Exact Mass | 288.097 |
| XLogP3 | -1.08726 |
| Mr | 71.097 |
| PSA | 137.37 |
| Sequence | - |
| Atom number | 33 |
| Bond number | 33 |
| Ring number | 1 |
| Rotor number | 6 |
| Residues number | 0 |
| Canonical smiles | N#CCCn1c(=O)n(CCC#N)c(=O)n(c1=O)CCC#N |
