Base information
| Cat. No. | |
| CAS No. | 1010116-95-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H6N4O4 |
| Molecular Weight | 234.168 |
| Exact Mass | 234.039 |
| XLogP3 | 0.2631 |
| Mr | 53.5323 |
| PSA | 129.06 |
| Sequence | - |
| Atom number | 23 |
| Bond number | 24 |
| Ring number | 2 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | OC(=O)c1cc(cc(c1)c1n[nH]nn1)C(=O)O |
