Base information
| Cat. No. | |
| CAS No. | 642-71-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H12O4 |
| Molecular Weight | 184.189 |
| Exact Mass | 184.074 |
| XLogP3 | 1.418 |
| Mr | 47.941 |
| PSA | 47.92 |
| Sequence | - |
| Atom number | 25 |
| Bond number | 25 |
| Ring number | 1 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | COc1c(OC)cc(cc1OC)O |
