Base information
| Cat. No. | |
| CAS No. | 853105-37-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H11NO4 |
| Molecular Weight | 197.188 |
| Exact Mass | 197.069 |
| XLogP3 | 0.2676 |
| Mr | 50.0735 |
| PSA | 68.53 |
| Sequence | - |
| Atom number | 25 |
| Bond number | 25 |
| Ring number | 1 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | Cn1cc(C(=O)OCC)c(cc1=O)O |
