3-Methylphenyl 4-methylbenzene-1-sulfonate
(3-methylphenyl) 4-methylbenzenesulfonate
Also Known As: 3-Methylphenyl 4-methylbenzene-1-sulfonate|3-Methylphenyl tosylate|m-tolyl p-toluenesulphonate|m-tolyl 4-methylbenzenesulfonate|(3-methylphenyl) 4-methylbenzenesulfonate|p-Toluenesulfonic acid, m-tolyl ester|3-methylphenyl 4-methylbenzenesulfonate|HS-5758|p-Toluenesulfonic acid 3-methylphenyl ester|J1.341.398C|AE-848/33607002
CAS: 3955-72-4
| Molecular Formula | C14H14O3S |
|---|---|
| Molecular Weight | 262.06638 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 51.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 262.06638 |
| Monoisotopic Mass | 262.06638 |
| Heavy Atoms | 18 |
| Complexity | 350.0 |
Chemical Identifiers
| CAS Number | 3955-72-4 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=CC(=C2)C |
| InChIKey | VIKTUZZYGHKELS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Organic Building Blocks (8 patents)
Organometallic Reagents (6 patents)
Photographic Chemicals (1 patents)
Product Overview
3-Methylphenyl 4-methylbenzene-1-sulfonate (CAS 3955-72-4), with molecular formula C14H14O3S and molecular weight 262.06638 g/mol. IUPAC: (3-methylphenyl) 4-methylbenzenesulfonate.
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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