Base information
| Cat. No. | |
| CAS No. | 85622-93-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C6H6N6O2 |
| Molecular Weight | 194.151 |
| Exact Mass | 194.055 |
| XLogP3 | -1.3778 |
| Mr | 44.3989 |
| PSA | 108.17 |
| Sequence | - |
| Atom number | 20 |
| Bond number | 21 |
| Ring number | 2 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | NC(=O)c1ncn2c1nnn(c2=O)C |
