Base information
| Cat. No. | |
| CAS No. | 12772-57-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C18H17ClO6 |
| Molecular Weight | 364.777 |
| Exact Mass | 364.071 |
| XLogP3 | 2.6916 |
| Mr | 91.1155 |
| PSA | 96.36 |
| Sequence | - |
| Atom number | 42 |
| Bond number | 44 |
| Ring number | 3 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | C[C@@H]1C[C@H]2O[C@@H]2/C=C\C=C\C(=O)Cc2c(C(=O)O1)c(O)cc(c2Cl)O |
