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≥98% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
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SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.
Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
| Canonical Smiles | [B-](F)(F)(F)F.C[S+](C)CC(=O)C1=CC=CC=C1 |
|---|---|
| IUPAC Name | dimethyl(phenacyl)sulfanium;tetrafluoroborate |
| InChIKey | NYDZUKNJLPHOOF-UHFFFAOYSA-N |
| INCHI | 1S/C10H13OS.BF4/c1-12(2)8-10(11)9-6-4-3-5-7-9;2-1(3,4)5/h3-7H,8H2,1-2H3;/q+1;-1 |
| Isomeric SMILES | [B-](F)(F)(F)F.C[S+](C)CC(=O)C1=CC=CC=C1 |
| PubChem CID | 2737123 |
| Molecular Weight | 268.08 |
| Reaxy-Rn | 6308011 |
Comprehensive hazard, handling, storage, and regulatory compliance document.
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View spec sheet →Taxonomy Tree
| Kingdom | Organic compounds |
|---|---|
| Superclass | Organic oxygen compounds |
| Class | Organooxygen compounds |
| Subclass | Carbonyl compounds |
| Intermediate Tree Nodes | Ketones - Aryl ketones - Phenylketones |
| Direct Parent | Alkyl-phenylketones |
| Alternative Parents | Benzoyl derivatives Aryl alkyl ketones Organic metalloid salts Organosulfur compounds Organic oxides Hydrocarbon derivatives |
| Molecular Framework | Aromatic homomonocyclic compounds |
| Substituents | Alkyl-phenylketone - Aryl alkyl ketone - Benzoyl - Benzenoid - Monocyclic benzene moiety - Organic metalloid salt - Organic oxide - Hydrocarbon derivative - Organic salt - Organosulfur compound - Aromatic homomonocyclic compound |
| Description | This compound belongs to the class of organic compounds known as alkyl-phenylketones. These are aromatic compounds containing a ketone substituted by one alkyl group, and a phenyl group. |
| External Descriptors | Not available |
| Solubility | Slightly soluble in Methanol |
|---|---|
| Sensitivity | light sensitive |
| Melt Point(°C) | 170 °C |
| Molecular Weight | 268.080 g/mol |
| XLogP3 | |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 3 |
| Exact Mass | 268.072 Da |
| Monoisotopic Mass | 268.072 Da |
| Topological Polar Surface Area | 18.100 Ų |
| Heavy Atom Count | 17 |
| Formal Charge | 0 |
| Complexity | 167.000 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| The total count of all stereochemical bonds | 0 |
| Covalently-Bonded Unit Count | 2 |