Base information
| Cat. No. | |
| CAS No. | 5287-46-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H15NO2S |
| Molecular Weight | 189.275 |
| Exact Mass | 189.082 |
| XLogP3 | 1.798 |
| Mr | 52.1662 |
| PSA | 88.62 |
| Sequence | - |
| Atom number | 27 |
| Bond number | 26 |
| Ring number | 0 |
| Rotor number | 5 |
| Residues number | 0 |
| Canonical smiles | CC(=CCSC[C@@H](C(=O)O)N)C |
