Base information
| Cat. No. | |
| CAS No. | 106429-57-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H8N2O3 |
| Molecular Weight | 192.171 |
| Exact Mass | 192.053 |
| XLogP3 | 0.6428 |
| Mr | 50.1989 |
| PSA | 74.95 |
| Sequence | - |
| Atom number | 22 |
| Bond number | 23 |
| Ring number | 2 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | COC(=O)c1ccc2c(c1)[nH]c(=O)[nH]2 |
