Phenyl prop-1-ynyl sulphone
prop-1-ynylsulfonylbenzene
Also Known As: Phenyl prop-1-ynyl sulphone|prop-1-ynylsulfonylbenzene|propynyl phenyl sulfone|1-phenylsulphonylpropyne|Phenyl(1-propynyl) sulfone|(1-Propynyl) phenyl sulfone|Phenyl (1-propynyl) sulfone|Benzene,(1-propyn-1-ylsulfonyl)-|(PROP-1-YNE-1-SULFONYL)BENZENE
CAS: 2525-41-9
| Molecular Formula | C9H8O2S |
|---|---|
| Molecular Weight | 180.0245 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 42.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 180.0245 |
| Monoisotopic Mass | 180.0245 |
| Heavy Atoms | 12 |
| Complexity | 290.0 |
Chemical Identifiers
| CAS Number | 2525-41-9 |
|---|---|
| SMILES | CC#CS(=O)(=O)C1=CC=CC=C1 |
| InChIKey | LYYXDHMLCDVGGI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Agrochemicals (3 patents)
Heterocyclic Building Blocks (12 patents)
Organic Building Blocks (1 patents)
Pharmaceutical Intermediates (4 patents)
Product Overview
Phenyl prop-1-ynyl sulphone (CAS 2525-41-9), with molecular formula C9H8O2S and molecular weight 180.0245 g/mol. IUPAC: prop-1-ynylsulfonylbenzene.
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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