Base information
| Cat. No. | |
| CAS No. | 120092-65-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C22H22ClD10NO3 |
| Molecular Weight | 404.009 |
| Exact Mass | 403.27 |
| XLogP3 | 4.1449 |
| Mr | 111.752 |
| PSA | 49.77 |
| Sequence | - |
| Atom number | 59 |
| Bond number | 59 |
| Ring number | 2 |
| Rotor number | 8 |
| Residues number | 0 |
| Canonical smiles | CCN(C(C([2H])([2H])[2H])([2H])[2H])C(C#CC(OC(=O)C(C1([2H])CCCCC1)(c1ccccc1)O)([2H])[2H])([2H])[2H].Cl |
