Base information
| Cat. No. | |
| CAS No. | 369656-76-8 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H12N2O5 |
| Molecular Weight | 231.181 |
| Exact Mass | 231.072 |
| XLogP3 | -1.8227 |
| Mr | 53.1073 |
| PSA | 104.55 |
| Sequence | - |
| Atom number | 28 |
| Bond number | 29 |
| Ring number | 2 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | OC[C@H]1O[C@H](C[C@@H]1O)[15n]1ccc(=O)[15nH][13c]1=O |
