Base information
| Cat. No. | |
| CAS No. | 21336-37-8 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C15H22O4S |
| Molecular Weight | 298.398 |
| Exact Mass | 298.124 |
| XLogP3 | 3.9068 |
| Mr | 78.8126 |
| PSA | 82.98 |
| Sequence | - |
| Atom number | 42 |
| Bond number | 43 |
| Ring number | 2 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | OCCC1(CCCCC1)c1cc(C)ccc1S(=O)(=O)O |
