Base information
| Cat. No. | |
| CAS No. | 16954-74-8 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C12H4N2O2 |
| Molecular Weight | 208.172 |
| Exact Mass | 208.027 |
| XLogP3 | 1.40936 |
| Mr | 53.355 |
| PSA | 81.72 |
| Sequence | - |
| Atom number | 20 |
| Bond number | 21 |
| Ring number | 2 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | N#CC(=C1C(=O)c2c(C1=O)cccc2)C#N |
