Description

4-Acetylphenyl benzenesulfonate (CAS No. 64101-66-2) is a high-purity organic compound with the molecular formula C₁₄H₁₂O₄S. This chemical is characterized by its sulfonate ester functional group, making it a valuable intermediate in synthetic organic chemistry. It is commonly utilized in research laboratories for the development of pharmaceuticals, agrochemicals, and advanced materials. The compound exhibits excellent stability under standard conditions and is supplied with comprehensive analytical data, including ¹H NMR, ¹³C NMR, and HPLC purity reports. Suitable for use in cross-coupling reactions, esterifications, and as a precursor for bioactive molecules, this product is rigorously tested to meet the highest industry standards for researchers and scientists.

Properties

• CAS Number: 64101-66-2
• Complexity: 396
• IUPAC Name: (4-acetylphenyl) benzenesulfonate
• InChI: InChI=1S/C14H12O4S/c1-11(15)12-7-9-13(10-8-12)18-19(16,17)14-5-3-2-4-6-14/h2-10H,1H3
• InChI Key: MEOYXYXANNAOTK-UHFFFAOYSA-N
• Exact Mass: 276.04563003
• Molecular Formula: C14H12O4S
• Molecular Weight: 276.31
• SMILES: CC(=O)C1=CC=C(C=C1)OS(=O)(=O)C2=CC=CC=C2
• Topological: 68.8
• Monoisotopic Mass: 276.04563003
• Synonyms: 4-acetylphenyl benzenesulfonate, 64101-66-2, Ethanone, 1-[4-[(phenylsulfonyl)oxy]phenyl]-, SCHEMBL687294, DTXSID90428850, AKOS001592600, AE-848/33606062, Z45511265

Application

4-Acetylphenyl benzenesulfonate is widely employed as a key intermediate in organic synthesis, particularly in the preparation of sulfonated aromatic compounds. It serves as a versatile building block for pharmaceutical research, enabling the development of novel drug candidates. Additionally, this compound is utilized in material science for the synthesis of advanced polymers and functionalized materials. Its stability and reactivity make it ideal for use in controlled chemical transformations.

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