Base information
| Cat. No. | |
| CAS No. | 1269822-96-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C7H5N3O3 |
| Molecular Weight | 179.133 |
| Exact Mass | 179.033 |
| XLogP3 | 0.3617 |
| Mr | 42.871 |
| PSA | 99.1 |
| Sequence | - |
| Atom number | 18 |
| Bond number | 19 |
| Ring number | 2 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | OC(=O)c1cc2c([nH]1)nncc2O |
