Base information
| Cat. No. | |
| CAS No. | 5817-96-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C6H5N3O |
| Molecular Weight | 135.123 |
| Exact Mass | 135.043 |
| XLogP3 | 0.1092 |
| Mr | 37.3247 |
| PSA | 54.88 |
| Sequence | - |
| Atom number | 15 |
| Bond number | 16 |
| Ring number | 2 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | O=C1Cc2c(N1)ncnc2 |
