Base information
| Cat. No. | |
| CAS No. | 76006-01-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H9N3O |
| Molecular Weight | 175.187 |
| Exact Mass | 175.075 |
| XLogP3 | 1.3998 |
| Mr | 48.9845 |
| PSA | 47.78 |
| Sequence | - |
| Atom number | 22 |
| Bond number | 23 |
| Ring number | 2 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | Cc1ncc2c(c1)cnn2C(=O)C |
