Base information
| Cat. No. | |
| CAS No. | 173933-40-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C12H12O4 |
| Molecular Weight | 220.221 |
| Exact Mass | 220.074 |
| XLogP3 | 2.1419 |
| Mr | 61.1048 |
| PSA | 77.76 |
| Sequence | - |
| Atom number | 28 |
| Bond number | 28 |
| Ring number | 1 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | CC(=O)/C=C(/C=C/c1ccc(c(c1)O)O)\O |
