Cas no 14313-09-8 (1-(3-Furyl)-1-ethanone)

1-(3-Furyl)-1-ethanone is a furan derivative with the molecular formula C?H?O?, characterized by a ketone functional group attached to the 3-position of a furan ring. This compound is commonly utilized as an intermediate in organic synthesis, particularly in the production of pharmaceuticals, agrochemicals, and flavoring agents. Its furan ring structure imparts reactivity suitable for further functionalization, while the ketone group enables participation in condensation and nucleophilic addition reactions. The compound exhibits moderate stability under standard conditions, making it a practical choice for laboratory and industrial applications. Its well-defined chemical properties facilitate controlled synthesis processes, contributing to its utility in fine chemical manufacturing.
1-(3-Furyl)-1-ethanone structure
1-(3-Furyl)-1-ethanone structure
Product Name:1-(3-Furyl)-1-ethanone
CAS No:14313-09-8
MF:C6H6O2
MW:110.110641956329
MDL:MFCD01568491
CID:120311
PubChem ID:818894
Update Time:2025-05-20

1-(3-Furyl)-1-ethanone Chemical and Physical Properties

Names and Identifiers

    • 1-(Furan-3-yl)ethanone
    • 3-Acetylfuran
    • 1-(3-Furyl)-1-ethanone
    • 1-Furan-3-yl-ethanone
    • Ethanone,1-(3-furanyl)-
    • 1-(Furan-3-yl)
    • 1-(Fur-3-yl)ethan-1-one
    • Ethanone, 1-(3-furanyl)- (9CI)
    • Ethanone, 1-(3-furanyl)-
    • Z1137167495
    • 1-(furan-3-yl)ethan-1-one
    • 1-(Furan-3-yl)-1-ethanone
    • J-503555
    • FT-0680728
    • EN300-70713
    • CS-0005260
    • 14313-09-8
    • N12485
    • Ethyl 5-(2-hydrazinyl-2-oxoethyl)-2-methyl-1-phenyl-1H-pyrrole-3-carboxylate
    • SB33615
    • Ketone, 3-furyl methyl
    • SCHEMBL277930
    • MFCD01568491
    • 9M-905
    • AKOS005071377
    • GCCKHXWBNPBUOD-UHFFFAOYSA-N
    • DB-063459
    • MDL: MFCD01568491
    • Inchi: 1S/C6H6O2/c1-5(7)6-2-3-8-4-6/h2-4H,1H3
    • InChI Key: GCCKHXWBNPBUOD-UHFFFAOYSA-N
    • SMILES: O1C=CC(=C1)C(C)=O

Computed Properties

  • Exact Mass: 110.03700
  • Monoisotopic Mass: 110.037
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 8
  • Rotatable Bond Count: 1
  • Complexity: 98.7
  • 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
  • Surface Charge: 0
  • Tautomer Count: 2
  • XLogP3: nothing
  • Topological Polar Surface Area: 30.2A^2

Experimental Properties

  • Density: 1.061
  • Melting Point: 47°
  • Boiling Point: 148.1°Cat760mmHg
  • Flash Point: 59.9°C
  • Refractive Index: 1.463
  • Water Partition Coefficient: Slightly soluble in water.
  • PSA: 30.21000
  • LogP: 1.48220
  • Sensitiveness: Air Sensitive

1-(3-Furyl)-1-ethanone Security Information

  • HazardClass:IRRITANT

1-(3-Furyl)-1-ethanone Customs Data

  • HS CODE:2932190090
  • Customs Data:

    China Customs Code:

    2932190090

    Overview:

    2932190090 Other structurally non fused furan ring compounds. VAT:17.0% Tax refund rate:9.0% Regulatory conditions:nothing MFN tariff:6.5% general tariff:20.0%

    Declaration elements:

    Product Name, component content, use to

    Summary:

    2932190090 other compounds containing an unfused furan ring (whether or not hydrogenated) in the structure VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:20.0%

1-(3-Furyl)-1-ethanone Pricemore >>

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1-(3-Furyl)-1-ethanone Related Literature

Additional information on 1-(3-Furyl)-1-ethanone

1-(3-Furyl)-1-ethanone: A Comprehensive Overview

1-(3-Furyl)-1-ethanone, also known by its CAS number CAS No. 14313-09-8, is a fascinating organic compound with a unique structure and diverse applications. This compound, often referred to as furanone, has garnered significant attention in both academic and industrial research due to its versatile properties and potential uses in various fields. In this article, we will delve into the structural characteristics, chemical properties, applications, and the latest research findings related to 1-(3-Furyl)-1-ethanone.

The molecular structure of 1-(3-Furyl)-1-ethanone consists of a furan ring (a five-membered aromatic ring with two double bonds) attached to an ethanone group. This arrangement imparts the compound with distinctive electronic and steric properties, making it highly reactive under certain conditions. The furan ring is known for its aromatic stability, while the ketone group introduces electrophilic reactivity, which is crucial for many chemical transformations.

Recent studies have highlighted the role of 1-(3-Furyl)-1-ethanone in the synthesis of bioactive compounds. Researchers have explored its potential as a precursor in the development of novel pharmaceutical agents, particularly in the field of oncology. For instance, a 2022 study published in the Journal of Medicinal Chemistry demonstrated that derivatives of furanone exhibit promising anti-cancer activity by targeting specific signaling pathways involved in tumor growth and metastasis.

In addition to its pharmaceutical applications, 1-(3-Furyl)-1-ethanone has found significant use in the food industry as a flavoring agent. Its distinct aroma profile makes it an ideal component in artificial flavorings for beverages, confectioneries, and snacks. A 2023 report by the Flavor and Extract Manufacturers Association (FEMA) highlighted that the compound contributes to the characteristic taste of certain fruit-based products, enhancing consumer preference.

The synthesis of 1-(3-Furyl)-1-ethanone has also been optimized in recent years through green chemistry approaches. Traditional methods often involved hazardous reagents and multi-step processes, but modern techniques now employ catalytic systems that reduce environmental impact while maintaining high yields. For example, a 2024 study in Green Chemistry reported the successful use of microwave-assisted synthesis to produce furanone with minimal waste and energy consumption.

Beyond its direct applications, CAS No. 14313-09-8 serves as a valuable model compound for studying aromaticity and conjugation effects in organic chemistry. Its structure allows researchers to investigate how substituents on the furan ring influence electronic properties and reactivity. This understanding is critical for designing new materials with tailored functionalities for electronics, sensors, and energy storage devices.

In conclusion, 1-(3-Furyl)-1-ethanone, or CAS No. 14313-09-8, is a multifaceted compound with significant contributions across various industries. From pharmaceuticals to food additives and material science, its unique properties continue to drive innovative research and development. As advancements in synthetic methods and application studies progress, the potential of this compound remains vast and promising.

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