Base information
| Cat. No. | |
| CAS No. | 469-54-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C16H15ClO6 |
| Molecular Weight | 338.74 |
| Exact Mass | 338.056 |
| XLogP3 | 2.2392 |
| Mr | 81.3675 |
| PSA | 78.9 |
| Sequence | - |
| Atom number | 38 |
| Bond number | 40 |
| Ring number | 3 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | COc1cc(OC)c(c2c1C(=O)[C@]1(O2)[C@H](C)CC(=O)CC1=O)Cl |
