Base information
| Cat. No. | |
| CAS No. | 771-03-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H8O4 |
| Molecular Weight | 168.147 |
| Exact Mass | 168.042 |
| XLogP3 | 0.8564 |
| Mr | 42.1615 |
| PSA | 67.51 |
| Sequence | - |
| Atom number | 20 |
| Bond number | 20 |
| Ring number | 1 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | Cc1cc(O)c(c(=O)o1)C(=O)C |
