Cas no 1756-31-6 (Ethanone, 1-[3,5-bis(1,1-dimethylethyl)phenyl]-)

Ethanone, 1-[3,5-bis(1,1-dimethylethyl)phenyl]- is a sterically hindered aromatic ketone characterized by its robust molecular structure due to the presence of tert-butyl substituents at the 3 and 5 positions of the phenyl ring. This compound exhibits enhanced stability against oxidative and thermal degradation, making it suitable for applications requiring high-performance intermediates in organic synthesis. Its electron-withdrawing carbonyl group, combined with the steric hindrance from the bulky tert-butyl groups, influences reactivity in selective chemical transformations. The compound is particularly valued in the development of specialty chemicals, where controlled reactivity and structural integrity are critical. Its purity and well-defined properties ensure reproducibility in research and industrial processes.
Ethanone, 1-[3,5-bis(1,1-dimethylethyl)phenyl]- structure
1756-31-6 structure
Product Name:Ethanone, 1-[3,5-bis(1,1-dimethylethyl)phenyl]-
CAS No:1756-31-6
MF:C16H24O
MW:232.361165046692
MDL:MFCD00598157
CID:98294
PubChem ID:10513778
Update Time:2025-06-12

Ethanone, 1-[3,5-bis(1,1-dimethylethyl)phenyl]- Chemical and Physical Properties

Names and Identifiers

    • Ethanone, 1-[3,5-bis(1,1-dimethylethyl)phenyl]-
    • 1-(3,5-ditert-butylphenyl)ethanone
    • 3,5-Di-t-butyl-acetophenon
    • 3,5-di-t-butylacetophenone
    • 3',5'-di-tert-butylacetophenone
    • 1-(3,5-di-tert-butylphenyl)ethanone
    • FT-0699978
    • 1-(3,5-DI-TERT-BUTYLPHENYL)ETHAN-1-ONE
    • AB01317302-02
    • D80062
    • SCHEMBL2776048
    • AKOS002211656
    • CS-0318413
    • 1756-31-6
    • DTXSID00441095
    • NCGC00322923-01
    • MDL: MFCD00598157
    • Inchi: 1S/C16H24O/c1-11(17)12-8-13(15(2,3)4)10-14(9-12)16(5,6)7/h8-10H,1-7H3
    • InChI Key: WZSMQEXDKGEYOW-UHFFFAOYSA-N
    • SMILES: O=C(C)C1C=C(C=C(C=1)C(C)(C)C)C(C)(C)C

Computed Properties

  • Exact Mass: 232.18300
  • Monoisotopic Mass: 232.182715385g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 17
  • Rotatable Bond Count: 3
  • Complexity: 255
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 4.9
  • Topological Polar Surface Area: 17.1?2

Experimental Properties

  • PSA: 17.07000
  • LogP: 4.48420

Ethanone, 1-[3,5-bis(1,1-dimethylethyl)phenyl]- Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
abcr
AB518459-1 g
3',5'-Di-tert-butylacetophenone, 97%; .
1756-31-6 97%
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€619.00 2023-04-17
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abcr
AB518459-5 g
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abcr
AB518459-1g
3',5'-Di-tert-butylacetophenone, 97%; .
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abcr
AB518459-5g
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Additional information on Ethanone, 1-[3,5-bis(1,1-dimethylethyl)phenyl]-

Ethanone, 1-[3,5-bis(1,1-dimethylethyl)phenyl]- (CAS No. 1756-31-6): A Comprehensive Overview of Its Properties and Applications

Ethanone, 1-[3,5-bis(1,1-dimethylethyl)phenyl]-, with the CAS No. 1756-31-6, is a specialized organic compound that has garnered significant attention in the chemical and industrial sectors. This compound, often referred to by its systematic name or CAS number, is a derivative of ethanone and features a phenyl ring substituted with bulky tert-butyl groups. Its unique molecular structure imparts distinct chemical and physical properties, making it valuable in various applications, including polymer stabilization, fragrance formulation, and specialty chemical synthesis.

The compound's chemical structure is characterized by the presence of two tert-butyl groups at the 3 and 5 positions of the phenyl ring, which significantly influences its reactivity and stability. This steric hindrance makes Ethanone, 1-[3,5-bis(1,1-dimethylethyl)phenyl]- resistant to oxidation and degradation, a property highly sought after in industries requiring durable materials. Researchers and manufacturers often explore its potential as an intermediate in the synthesis of high-performance polymers and additives, where thermal stability is paramount.

In recent years, the demand for specialty ketones like Ethanone, 1-[3,5-bis(1,1-dimethylethyl)phenyl]- has surged due to their role in advanced material science. For instance, its incorporation into polymer matrices enhances UV resistance and mechanical strength, addressing common challenges in the plastics industry. Additionally, its subtle aromatic properties have led to its use in fragrance and flavor applications, where it contributes to complex scent profiles. These versatile applications align with current trends in sustainable and high-performance material development, a topic frequently searched by professionals and enthusiasts alike.

From an environmental perspective, the compound's stability also raises questions about its biodegradability and ecological impact, topics increasingly relevant in today's eco-conscious market. Studies on its environmental fate and toxicity are limited, prompting calls for further research to ensure its safe use. This gap in knowledge presents an opportunity for scientists to investigate greener alternatives or improved handling protocols, a subject often queried in academic and industrial forums.

For those sourcing Ethanone, 1-[3,5-bis(1,1-dimethylethyl)phenyl]-, understanding its synthesis and handling is critical. The compound is typically synthesized through Friedel-Crafts acylation, a well-established method in organic chemistry. However, optimizing yield and purity remains a challenge, driving innovation in catalytic processes and reaction conditions. Manufacturers and suppliers frequently highlight these technical aspects to meet the stringent requirements of end-users, particularly in pharmaceuticals and agrochemicals, where purity is non-negotiable.

In conclusion, Ethanone, 1-[3,5-bis(1,1-dimethylethyl)phenyl]- (CAS No. 1756-31-6) stands out as a multifaceted compound with broad industrial relevance. Its unique chemical properties and applications in polymer science, fragrance, and specialty chemicals make it a subject of ongoing research and commercial interest. As industries continue to prioritize sustainability and performance, this compound is likely to remain a key player in the evolving landscape of advanced materials.

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