Base information
| Cat. No. | |
| CAS No. | 1215373-23-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H2D5O3 |
| Molecular Weight | 168.181 |
| Exact Mass | 168.071 |
| XLogP3 | 1.6885 |
| Mr | 44.8548 |
| PSA | 50.44 |
| Sequence | - |
| Atom number | 19 |
| Bond number | 20 |
| Ring number | 2 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | O=c1oc2C=[C]([2H])(O)C(=C(c2c(c1[2H])[2H])[2H])[2H] |
