Base information
| Cat. No. | |
| CAS No. | 126840-22-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C5HD11O |
| Molecular Weight | 99.216 |
| Exact Mass | 99.1579 |
| XLogP3 | 1.1689 |
| Mr | 27.3108 |
| PSA | 20.23 |
| Sequence | - |
| Atom number | 18 |
| Bond number | 17 |
| Ring number | 0 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | [2H]C(C(C(C(O)([2H])[2H])([2H])[2H])([2H])[2H])(C([2H])([2H])[2H])[2H] |
