Base information
| Cat. No. | |
| CAS No. | 27585-28-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C6H9NO4 |
| Molecular Weight | 159.14 |
| Exact Mass | 159.053 |
| XLogP3 | -0.7636 |
| Mr | 39.1756 |
| PSA | 77.84 |
| Sequence | - |
| Atom number | 20 |
| Bond number | 20 |
| Ring number | 1 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | O=CN1C[C@@H](C[C@H]1C(=O)O)O |
