Base information
| Cat. No. | |
| CAS No. | 115823-68-2 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C6H9ClO |
| Molecular Weight | 132.588 |
| Exact Mass | 132.034 |
| XLogP3 | 0.9995 |
| Mr | 35.1138 |
| PSA | 20.23 |
| Sequence | - |
| Atom number | 17 |
| Bond number | 16 |
| Ring number | 0 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | CC(C#CC)(CCl)O |
