Base information
| Cat. No. | |
| CAS No. | 2931-90-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H8O4 |
| Molecular Weight | 180.157 |
| Exact Mass | 180.042 |
| XLogP3 | 1.0258 |
| Mr | 45.732 |
| PSA | 63.6 |
| Sequence | - |
| Atom number | 21 |
| Bond number | 21 |
| Ring number | 1 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | O=Cc1cc(OC)c(c(c1)C=O)O |
