Base information
| Cat. No. | |
| CAS No. | 36885-31-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C20H20BaF14O4 |
| Molecular Weight | 727.675 |
| Exact Mass | 728.019 |
| XLogP3 | 7.5986 |
| Mr | 100.298 |
| PSA | 52.6 |
| Sequence | - |
| Atom number | 59 |
| Bond number | 58 |
| Ring number | 0 |
| Rotor number | 12 |
| Residues number | 0 |
| Canonical smiles | O=C(C(C(C(F)(F)F)(F)F)(F)F)/C=C(/C(C)(C)C)\O[Ba]O/C(=C\C(=O)C(C(C(F)(F)F)(F)F)(F)F)/C(C)(C)C |
