Base information
| Cat. No. | |
| CAS No. | 53587-33-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H8D2O4 |
| Molecular Weight | 184.186 |
| Exact Mass | 184.07 |
| XLogP3 | 1.0279 |
| Mr | 46.5018 |
| PSA | 66.76 |
| Sequence | - |
| Atom number | 23 |
| Bond number | 23 |
| Ring number | 1 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | COc1cc(ccc1O)C(C(=O)O)([2H])[2H] |
