Base information
| Cat. No. | |
| CAS No. | 570412-84-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C12H21NO4S |
| Molecular Weight | 275.364 |
| Exact Mass | 275.119 |
| XLogP3 | 2.2234 |
| Mr | 70.6492 |
| PSA | 78.69 |
| Sequence | - |
| Atom number | 39 |
| Bond number | 38 |
| Ring number | 1 |
| Rotor number | 5 |
| Residues number | 0 |
| Canonical smiles | CC(c1cc[n+](cc1)CCCS(=O)(=O)[O-])(C)C.O |
