Base information
| Cat. No. | |
| CAS No. | 85391-05-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H18ClNO2S |
| Molecular Weight | 227.752 |
| Exact Mass | 227.075 |
| XLogP3 | 2.5207 |
| Mr | 59.1184 |
| PSA | 77.62 |
| Sequence | - |
| Atom number | 31 |
| Bond number | 29 |
| Ring number | 0 |
| Rotor number | 6 |
| Residues number | 0 |
| Canonical smiles | CSCC[C@@H](C(=O)OC(C)C)N.Cl |
