Base information
| Cat. No. | |
| CAS No. | 31098-21-2 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C7H11KO5S |
| Molecular Weight | 246.323 |
| Exact Mass | 245.996 |
| XLogP3 | 1.1218 |
| Mr | 45.2584 |
| PSA | 91.88 |
| Sequence | - |
| Atom number | 25 |
| Bond number | 23 |
| Ring number | 0 |
| Rotor number | 6 |
| Residues number | 0 |
| Canonical smiles | O=C(C(=C)C)OCCCS(=O)(=O)[O-].[K+] |
