Base information
| Cat. No. | |
| CAS No. | 119-44-8 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C6H5N5O2 |
| Molecular Weight | 179.136 |
| Exact Mass | 179.044 |
| XLogP3 | -0.8302 |
| Mr | 45.1838 |
| PSA | 117.52 |
| Sequence | - |
| Atom number | 18 |
| Bond number | 19 |
| Ring number | 2 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | O=c1cnc2c([nH]1)c(=O)[nH]c(n2)N |
