Base information
| Cat. No. | |
| CAS No. | 188114-91-2 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C11H13NaO5S |
| Molecular Weight | 280.273 |
| Exact Mass | 280.038 |
| XLogP3 | 2.623 |
| Mr | 60.1094 |
| PSA | 91.88 |
| Sequence | - |
| Atom number | 31 |
| Bond number | 30 |
| Ring number | 1 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | O=C(C(C)(C)C)Oc1ccc(cc1)S(=O)(=O)[O-].[Na+] |
