Butane-1,4-diyl bis(2,5-dimethylbenzenesulfonate)
4-(2,5-dimethylphenyl)sulfonyloxybutyl 2,5-dimethylbenzenesulfonate
Also Known As: butane-1,4-diyl bis(2,5-dimethylbenzenesulfonate)|Butane-1,4-diyl bis(2,5-dimethylbenzene-1-sulfonate)|4-(2,5-dimethylphenyl)sulfonyloxybutyl 2,5-dimethylbenzenesulfonate
CAS: 960-88-3
| Molecular Formula | C20H26O6S2 |
|---|---|
| Molecular Weight | 426.1171 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 104.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 426.1171 |
| Monoisotopic Mass | 426.1171 |
| Heavy Atoms | 28 |
| Complexity | 616.0 |
Chemical Identifiers
| CAS Number | 960-88-3 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)C)S(=O)(=O)OCCCCOS(=O)(=O)C2=C(C=CC(=C2)C)C |
| InChIKey | WKJDVLUVVZBKBJ-UHFFFAOYSA-N |
Product Overview
Butane-1,4-diyl bis(2,5-dimethylbenzenesulfonate) (CAS 960-88-3), with molecular formula C20H26O6S2 and molecular weight 426.1171 g/mol. IUPAC: 4-(2,5-dimethylphenyl)sulfonyloxybutyl 2,5-dimethylbenzenesulfonate.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
View MSDS →
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