Base information
| Cat. No. | |
| CAS No. | 178454-81-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C24H21ClO6 |
| Molecular Weight | 440.873 |
| Exact Mass | 440.103 |
| XLogP3 | 4.0213 |
| Mr | 113.597 |
| PSA | 78.9 |
| Sequence | - |
| Atom number | 52 |
| Bond number | 55 |
| Ring number | 4 |
| Rotor number | 8 |
| Residues number | 0 |
| Canonical smiles | O=C(COc1cccc(c1)Cl)/C=C/[C@H]1[C@@H](C[C@H]2[C@@H]1CC(=O)O2)OC(=O)c1ccccc1 |
