Base information
| Cat. No. | |
| CAS No. | 649-65-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C6H6F6O2 |
| Molecular Weight | 224.101 |
| Exact Mass | 224.027 |
| XLogP3 | 1.8212 |
| Mr | 32.7378 |
| PSA | 37.3 |
| Sequence | - |
| Atom number | 20 |
| Bond number | 19 |
| Ring number | 0 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | O=C(C(F)(F)F)CC(C(F)(F)F)(O)C |
