Base information
| Cat. No. | |
| CAS No. | 15425-09-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C10H12N2O4 |
| Molecular Weight | 224.213 |
| Exact Mass | 224.08 |
| XLogP3 | -0.4075 |
| Mr | 53.6568 |
| PSA | 73.58 |
| Sequence | - |
| Atom number | 28 |
| Bond number | 30 |
| Ring number | 3 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | O[C@H]1C[C@H]2O[C@@H]1COc1n2cc(C)c(=O)n1 |
