Base information
| Cat. No. | |
| CAS No. | 126394-70-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C18H16O6 |
| Molecular Weight | 328.316 |
| Exact Mass | 328.095 |
| XLogP3 | 2.736 |
| Mr | 85.2535 |
| PSA | 93.06 |
| Sequence | - |
| Atom number | 40 |
| Bond number | 42 |
| Ring number | 3 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | CCC(=O)O[C@@H]1[C@H](Oc2c(C1=O)c(O)cc(c2)O)c1ccccc1 |
