Sulfone, 3-butynyl p-tolyl
1-but-3-ynylsulfonyl-4-methylbenzene
Also Known As: Sulfone, 3-butynyl p-tolyl|Sulfone, 3-butynyl p-tolyl,|1-but-3-ynylsulfonyl-4-methylbenzene|1-(but-3-yne-1-sulfonyl)-4-methylbenzene|J3.755.409J
CAS: 36832-52-7
| Molecular Formula | C11H12O2S |
|---|---|
| Molecular Weight | 208.0558 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 42.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 208.0558 |
| Monoisotopic Mass | 208.0558 |
| Heavy Atoms | 14 |
| Complexity | 307.0 |
Chemical Identifiers
| CAS Number | 36832-52-7 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)CCC#C |
| InChIKey | XKDXCVCQIUFLNU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Agrochemicals (6 patents)
Heterocyclic Building Blocks (6 patents)
Product Overview
Sulfone, 3-butynyl p-tolyl (CAS 36832-52-7), with molecular formula C11H12O2S and molecular weight 208.0558 g/mol. IUPAC: 1-but-3-ynylsulfonyl-4-methylbenzene.
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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