Base information
| Cat. No. | |
| CAS No. | 1219804-65-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H6D4O2 |
| Molecular Weight | 142.188 |
| Exact Mass | 142.093 |
| XLogP3 | 1.0577 |
| Mr | 38.9028 |
| PSA | 29.46 |
| Sequence | - |
| Atom number | 20 |
| Bond number | 20 |
| Ring number | 1 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | [2H]C(C(O)([2H])[2H])(Oc1ccccc1)[2H] |
