Base information
| Cat. No. | |
| CAS No. | 84472-86-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H13N3O4 |
| Molecular Weight | 227.217 |
| Exact Mass | 227.091 |
| XLogP3 | -1.156 |
| Mr | 54.6529 |
| PSA | 110.34 |
| Sequence | - |
| Atom number | 29 |
| Bond number | 30 |
| Ring number | 2 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | OC[C@H]1O[C@H](C[C@@H]1N)n1ccc(=O)[nH]c1=O |
