Base information
| Cat. No. | |
| CAS No. | 111897-35-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C22H29FO6 |
| Molecular Weight | 408.46 |
| Exact Mass | 408.195 |
| XLogP3 | 0.8665 |
| Mr | 103.118 |
| PSA | 115.06 |
| Sequence | - |
| Atom number | 58 |
| Bond number | 61 |
| Ring number | 4 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | OCC(=O)[C@@]1(O)[C@H](C)C[C@@H]2[C@]1(C)C[C@H](O)[C@]1([C@H]2C[C@@H](C2=CC(=O)C=C[C@]12C)O)F |
