Base information
| Cat. No. | |
| CAS No. | 1216788-76-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H11ClD4NO3 |
| Molecular Weight | 224.698 |
| Exact Mass | 224.099 |
| XLogP3 | 2.7584 |
| Mr | 56.799 |
| PSA | 75.71 |
| Sequence | - |
| Atom number | 29 |
| Bond number | 28 |
| Ring number | 1 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | CO[C]1(=C(O)C=CC(=C1)CC(N([2H])[2H])([2H])[2H])O.Cl |
