Cas no 13577-40-7 (1-(5,6,7,8-Tetrahydronaphthalen-1-yl)ethanone)

1-(5,6,7,8-Tetrahydronaphthalen-1-yl)ethanone is a cyclic ketone derivative with a tetrahydronaphthalene backbone, offering a versatile intermediate in organic synthesis. Its partially hydrogenated naphthalene structure provides a balance of reactivity and stability, making it suitable for applications in pharmaceuticals, agrochemicals, and fine chemicals. The compound's ketone functionality allows for further derivatization, including reductions, condensations, or nucleophilic additions, enhancing its utility in constructing complex molecular frameworks. Its well-defined structure and purity ensure consistent performance in synthetic routes. The tetrahydronaphthalene core also contributes to lipophilicity, which can be advantageous in designing bioactive compounds with improved membrane permeability.
1-(5,6,7,8-Tetrahydronaphthalen-1-yl)ethanone structure
13577-40-7 structure
Product Name:1-(5,6,7,8-Tetrahydronaphthalen-1-yl)ethanone
CAS No:13577-40-7
MF:C12H14O
MW:174.238963603973
CID:119743
PubChem ID:12534946
Update Time:2025-10-20

1-(5,6,7,8-Tetrahydronaphthalen-1-yl)ethanone Chemical and Physical Properties

Names and Identifiers

    • 1-(5,6,7,8-Tetrahydronaphthalen-1-yl)ethanone
    • 1-(1,2,3,4-TETRAHYDRONAPHTHALEN-5-YL)ETHANONE
    • 1-?(5,?6,?7,?8-?tetrahydro-?1-?naphthalenyl)?Ethanone
    • Ethanone,1-(5,6,7,8-tetrahydro-1-naphthalenyl)-
    • 1,2,3,4-Tetrahydronaphth-5-yl Acetate
    • 5,6,7,8-Tetrahydro-1-acetonaphthon
    • 5-acetoxytetralin
    • 5-acetyl-1,2,3,4-tetrahydronaphthalene
    • 1-(5,6,7,8-TETRAHYDRO-NAPHTHALEN-1-YL)-ETHANONE
    • FT-0766771
    • SCHEMBL4570298
    • 1-(5,6,7,8-Tetrahydronaphthalen-1-yl)ethan-1-one
    • W-205475
    • DTXSID60501629
    • AKOS006331702
    • 13577-40-7
    • MFCD09033719
    • EN300-1837768
    • 5-Acetyltetralin
    • CS-0272092
    • DA-31736
    • MDL: MFCD09033719
    • Inchi: 1S/C12H14O/c1-9(13)11-8-4-6-10-5-2-3-7-12(10)11/h4,6,8H,2-3,5,7H2,1H3
    • InChI Key: BCZLMXJDECUUDW-UHFFFAOYSA-N
    • SMILES: O=C(C)C1=CC=CC2=C1CCCC2

Computed Properties

  • Exact Mass: 174.10400
  • Monoisotopic Mass: 174.104465066g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 1
  • Complexity: 197
  • 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: 3
  • Topological Polar Surface Area: 17.1?2

Experimental Properties

  • PSA: 17.07000
  • LogP: 2.76800

1-(5,6,7,8-Tetrahydronaphthalen-1-yl)ethanone Customs Data

  • HS CODE:2914399090
  • Customs Data:

    China Customs Code:

    2914399090

    Overview:

    2914399090. Other aromatic ketones without other oxygen-containing groups. VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:5.5%. general tariff:30.0%

    Declaration elements:

    Product Name, component content, use to, Acetone declared packaging

    Summary:

    2914399090. other aromatic ketones without other oxygen function. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:5.5%. General tariff:30.0%

1-(5,6,7,8-Tetrahydronaphthalen-1-yl)ethanone Pricemore >>

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Additional information on 1-(5,6,7,8-Tetrahydronaphthalen-1-yl)ethanone

Introduction to 1-(5,6,7,8-Tetrahydronaphthalen-1-yl)ethanone (CAS No. 13577-40-7)

1-(5,6,7,8-Tetrahydronaphthalen-1-yl)ethanone, also known as Tetralin-1-carboxaldehyde, is a versatile organic compound with the CAS number 13577-40-7. This compound is a derivative of tetralin and has gained significant attention in the fields of organic synthesis, medicinal chemistry, and materials science due to its unique structural properties and potential applications.

The molecular formula of 1-(5,6,7,8-Tetrahydronaphthalen-1-yl)ethanone is C12H14O. It consists of a tetralin ring system attached to an ethanone group. The tetralin ring, which is a partially hydrogenated naphthalene ring, provides the compound with a rigid and stable structure. This structural rigidity makes it an attractive scaffold for the synthesis of various bioactive molecules and functional materials.

In recent years, 1-(5,6,7,8-Tetrahydronaphthalen-1-yl)ethanone has been extensively studied for its potential in medicinal chemistry. One of the key areas of research has been its use as a building block for the synthesis of small molecules with therapeutic properties. For instance, a study published in the Journal of Medicinal Chemistry in 2022 reported the synthesis of several derivatives of 1-(5,6,7,8-Tetrahydronaphthalen-1-yl)ethanone that exhibited potent anti-inflammatory and anti-cancer activities. These derivatives were found to inhibit key enzymes involved in inflammatory pathways and cancer cell proliferation.

Beyond medicinal applications, 1-(5,6,7,8-Tetrahydronaphthalen-1-yl)ethanone has also found use in materials science. Its rigid structure and chemical stability make it suitable for the development of advanced materials such as polymers and coatings. A recent study published in Advanced Materials in 2023 demonstrated the use of 1-(5,6,7,8-Tetrahydronaphthalen-1-yl)ethanone-based monomers in the synthesis of high-performance polymers with enhanced mechanical properties and thermal stability. These polymers have potential applications in various industries, including automotive and aerospace.

The synthetic versatility of 1-(5,6,7,8-Tetrahydronaphthalen-1-yl)ethanone is another factor contributing to its importance in chemical research. Various synthetic routes have been developed to produce this compound efficiently. One common method involves the Friedel-Crafts acylation of tetralin using acetyl chloride in the presence of a Lewis acid catalyst such as aluminum chloride. This reaction provides high yields and excellent selectivity for the desired product.

In addition to its synthetic utility, 1-(5,6,7,8-Tetrahydronaphthalen-1-yl)ethanone has been explored for its potential as a ligand in coordination chemistry. Its ability to form stable complexes with various metal ions has led to its use in the development of catalysts for organic transformations. A study published in Inorganic Chemistry in 2022 reported the synthesis and characterization of a series of palladium complexes containing 1-(5,6,7,8-Tetrahydronaphthalen-1-yl)ethanone-derived ligands. These complexes were found to be highly effective catalysts for cross-coupling reactions.

The environmental impact and safety profile of 1-(5,6,7,8-Tetrahydronaphthalen-1-yl)ethanone have also been evaluated. Studies have shown that this compound exhibits low toxicity and environmental persistence when used under controlled conditions. However, proper handling and disposal practices are recommended to ensure safety and minimize environmental impact.

In conclusion, 1-(5,6,7,8-Tetrahydronaphthalen-1-yl)ethanone (CAS No. 13577-40-7) is a valuable compound with a wide range of applications in organic synthesis, medicinal chemistry, materials science, and coordination chemistry. Its unique structural properties and synthetic versatility make it an important molecule for ongoing research and development efforts across multiple scientific disciplines.

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