Base information
| Cat. No. | |
| CAS No. | 6813-38-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C12H8N2O4 |
| Molecular Weight | 244.203 |
| Exact Mass | 244.048 |
| XLogP3 | 1.54 |
| Mr | 61.3866 |
| PSA | 100.38 |
| Sequence | - |
| Atom number | 26 |
| Bond number | 27 |
| Ring number | 2 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | OC(=O)c1ccnc(c1)c1nccc(c1)C(=O)O |
