Base information
| Cat. No. | |
| CAS No. | 5442-12-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H8O4 |
| Molecular Weight | 168.147 |
| Exact Mass | 168.042 |
| XLogP3 | -0.1366 |
| Mr | 36.798 |
| PSA | 52.6 |
| Sequence | - |
| Atom number | 20 |
| Bond number | 22 |
| Ring number | 3 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | O=C1OC(=O)C2C1C1CCC2O1 |
