Cas no 2419-68-3 (1-(3,4-Methylenedioxyphenyl)-4,4-dimethyl-pent-1-en-3-one)

1-(3,4-Methylenedioxyphenyl)-4,4-dimethyl-pent-1-en-3-one is a specialized organic compound featuring a methylenedioxyphenyl moiety linked to a dimethyl-substituted pentenone framework. Its distinct structure, combining an aromatic ring with an α,β-unsaturated ketone, makes it a valuable intermediate in synthetic chemistry, particularly for applications requiring electrophilic or conjugated systems. The compound’s rigid, substituted backbone enhances stability while offering reactivity for further functionalization. Its methylenedioxy group may also contribute to unique electronic properties, useful in pharmaceutical or agrochemical research. This product is suited for controlled synthesis of complex molecules, where precise structural features are critical for desired reactivity or biological activity.
1-(3,4-Methylenedioxyphenyl)-4,4-dimethyl-pent-1-en-3-one structure
2419-68-3 structure
Product Name:1-(3,4-Methylenedioxyphenyl)-4,4-dimethyl-pent-1-en-3-one
CAS No:2419-68-3
MF:C14H16O3
MW:232.275044441223
CID:257264
PubChem ID:6444507
Update Time:2025-05-24

1-(3,4-Methylenedioxyphenyl)-4,4-dimethyl-pent-1-en-3-one Chemical and Physical Properties

Names and Identifiers

    • 1-Penten-3-one,1-(1,3-benzodioxol-5-yl)-4,4-dimethyl-
    • 1-(3,4-Methylenedioxyphenyl)-4,4-dimethyl-pent-1-en-3-one
    • (E)-1-(1,3-benzodioxol-5-yl)-4,4-dimethylpent-1-en-3-one
    • 1-(3,4-METHYLENEDIOXY-PHENYL)-4,4-DIMETHYL-PENT-1-EN-3-ONE
    • 1-(1,3-Benzodioxol-5-yl)-4,4-dimethyl-1-penten-3-one
    • AC1O60ZO
    • FT-0671734
    • FT-0671735
    • LS-102139
    • SureCN1046950
    • 1262795-35-6
    • starbld0018976
    • E)-1-(3,4-Methylenedioxyphenyl)-4,4-Dimethyl-Pent-1-En-3-One
    • 1-(Benzo[d][1,3]dioxol-5-yl)-4,4-dimethylpent-1-en-3-one
    • SCHEMBL1046951
    • SCHEMBL1046950
    • 1-Penten-3-one, 1-(1,3-benzodioxol-5-yl)-4,4-dimethyl-
    • WS-01622
    • (1E)-1-(2H-1,3-BENZODIOXOL-5-YL)-4,4-DIMETHYLPENT-1-EN-3-ONE
    • 2419-68-3
    • W12172
    • J-015391
    • 1-(3,4-Methylenedioxyphenyl)-4,4-dimethyl-d6-pent-1-en-3-one-d3
    • MFCD00017633
    • 144850-45-3
    • LXFNQCGNCFRKRR-FNORWQNLSA-N
    • (E)-1-(Benzo[d][1,3]dioxol-5-yl)-4,4-dimethylpent-1-en-3-one
    • DTXSID601035965
    • (E)-4,4-dimethyl-1-(3,4-methylenedioxyphenyl)pent-1-en-3-one
    • (1E)-1-(1,3-Benzodioxol-5-yl)-4,4-dimethyl-1-penten-3-one
    • 3-Deshydroxy 3-Keto Stiripentol
    • (1E)-1-(1,3-Benzodioxol-5-yl)-4,4-dimethyl-1-penten-3-one;
    • DB-189825
    • Inchi： 1S/C14H16O3/c1-14(2,3)13(15)7-5-10-4-6-11-12(8-10)17-9-16-11/h4-8H,9H2,1-3H3/b7-5+
    • InChI Key： LXFNQCGNCFRKRR-FNORWQNLSA-N
    • SMILES： O1COC2C=CC(=CC1=2)/C=C/C(C(C)(C)C)=O

Computed Properties

  • Exact Mass: 232.11000
  • Monoisotopic Mass: 232.109944
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 17
  • Rotatable Bond Count: 3
  • Complexity: 314
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 1
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 3.6
  • Topological Polar Surface Area: 35.5

Experimental Properties

  • Melting Point: 91-93°C
  • PSA: 35.53000
  • LogP: 3.04370

1-(3,4-Methylenedioxyphenyl)-4,4-dimethyl-pent-1-en-3-one Security Information

  • Storage Condition：-20°C Freezer

1-(3,4-Methylenedioxyphenyl)-4,4-dimethyl-pent-1-en-3-one Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
Chemenu
CM323924-1g
1-(Benzo[d][1,3]dioxol-5-yl)-4,4-dimethylpent-1-en-3-one
 2419-68-3 95%
1g
 $281 2021-06-17
Chemenu
CM323924-5g
1-(Benzo[d][1,3]dioxol-5-yl)-4,4-dimethylpent-1-en-3-one
 2419-68-3 95%
5g
 $898 2021-06-17
TRC
M303970-50mg
1-(3,4-Methylenedioxyphenyl)-4,4-dimethyl-pent-1-en-3-one
 2419-68-3
50mg
 $ 115.00 2023-09-07
TRC
M303970-100mg
1-(3,4-Methylenedioxyphenyl)-4,4-dimethyl-pent-1-en-3-one
 2419-68-3
100mg
 $ 161.00 2023-09-07
TRC
M303970-250mg
1-(3,4-Methylenedioxyphenyl)-4,4-dimethyl-pent-1-en-3-one
 2419-68-3
250mg
 $ 402.00 2023-09-07
TRC
M303970-500mg
1-(3,4-Methylenedioxyphenyl)-4,4-dimethyl-pent-1-en-3-one
 2419-68-3
500mg
 $770.00 2023-05-18
TRC
M303970-1g
1-(3,4-Methylenedioxyphenyl)-4,4-dimethyl-pent-1-en-3-one
 2419-68-3
1g
 $ 945.00 2022-06-04
Chemenu
CM323924-1g
1-(Benzo[d][1,3]dioxol-5-yl)-4,4-dimethylpent-1-en-3-one
 2419-68-3 95%
1g
 $281 2024-07-28
Chemenu
CM323924-5g
1-(Benzo[d][1,3]dioxol-5-yl)-4,4-dimethylpent-1-en-3-one
 2419-68-3 95%
5g
 $898 2024-07-28
Ambeed
A818163-250mg
1-(Benzo[d][1,3]dioxol-5-yl)-4,4-dimethylpent-1-en-3-one
 2419-68-3 95+%
250mg
 $159.0 2025-02-21

1-(3,4-Methylenedioxyphenyl)-4,4-dimethyl-pent-1-en-3-one Suppliers

Amadis Chemical Company Limited
Gold Member
Audited Supplier Audited Supplier
(CAS:2419-68-3)1-(3,4-Methylenedioxyphenyl)-4,4-dimethyl-pent-1-en-3-one
Order Number:A1008684
Stock Status:in Stock
Quantity:1g
Purity:99%
Pricing Information Last Updated:Thursday, 29 August 2024 15:07
Price ($):272.0

1-(3,4-Methylenedioxyphenyl)-4,4-dimethyl-pent-1-en-3-one Related Literature

Related Categories

Additional information on 1-(3,4-Methylenedioxyphenyl)-4,4-dimethyl-pent-1-en-3-one

Introduction to 1-(3,4-Methylenedioxyphenyl)-4,4-dimethyl-pent-1-en-3-one (CAS No. 2419-68-3)

1-(3,4-Methylenedioxyphenyl)-4,4-dimethyl-pent-1-en-3-one, also known by its CAS number 2419-68-3, is a versatile organic compound that has garnered significant attention in the fields of medicinal chemistry and pharmaceutical research. This compound is characterized by its unique structural features, which include a methylenedioxyphenyl group and a substituted pentenone moiety. These structural elements contribute to its potential biological activities and make it a valuable candidate for various applications in drug discovery and development.

The chemical structure of 1-(3,4-Methylenedioxyphenyl)-4,4-dimethyl-pent-1-en-3-one is defined by the presence of a benzene ring with a methylenedioxy group at the 3,4 positions, which is known to influence the compound's pharmacological properties. The pentenone portion of the molecule, with its double bond and dimethyl substitution, adds to its reactivity and stability. This combination of functional groups makes the compound an interesting target for synthetic chemists and medicinal chemists alike.

Recent studies have explored the potential therapeutic applications of 1-(3,4-Methylenedioxyphenyl)-4,4-dimethyl-pent-1-en-3-one. One notable area of research is its anti-inflammatory properties. In vitro and in vivo studies have shown that this compound can effectively inhibit the production of pro-inflammatory cytokines such as TNF-α and IL-6. These findings suggest that it may have potential as a treatment for inflammatory diseases such as rheumatoid arthritis and inflammatory bowel disease.

Another area of interest is the compound's potential as an antioxidant. Oxidative stress is a key factor in the development of various diseases, including neurodegenerative disorders and cardiovascular diseases. Research has demonstrated that 1-(3,4-Methylenedioxyphenyl)-4,4-dimethyl-pent-1-en-3-one possesses strong antioxidant activity, which can help mitigate oxidative damage to cells and tissues. This property makes it a promising candidate for the development of novel therapeutic agents targeting oxidative stress-related conditions.

In addition to its anti-inflammatory and antioxidant properties, 1-(3,4-Methylenedioxyphenyl)-4,4-dimethyl-pent-1-en-3-one has also been investigated for its potential anticancer effects. Studies have shown that it can induce apoptosis in cancer cells through multiple mechanisms, including the modulation of cell cycle progression and the activation of caspase pathways. These findings highlight its potential as a lead compound for the development of new anticancer drugs.

The synthesis of 1-(3,4-Methylenedioxyphenyl)-4,4-dimethyl-pent-1-en-3-one has been optimized using various methodologies to improve yield and purity. One common approach involves the condensation of 3,4-methylenedioxybenzaldehyde with an appropriate ketone or aldehyde followed by subsequent modifications to introduce the desired substituents. Advances in synthetic chemistry have enabled researchers to produce this compound on a larger scale, facilitating further preclinical and clinical studies.

Clinical trials are currently underway to evaluate the safety and efficacy of 1-(3,4-Methylenedioxyphenyl)-4,4-dimethyl-pent-1-en-3-one in various therapeutic contexts. Preliminary results from phase I trials have shown promising outcomes in terms of safety profiles and pharmacokinetic properties. These findings provide a strong foundation for advancing this compound into more advanced stages of clinical testing.

Beyond its therapeutic applications, 1-(3,4-Methylenedioxyphenyl)-4,4-dimethyl-pent-1-en-3-one has also found use in other areas such as chemical biology and materials science. Its unique chemical structure makes it suitable for use as a building block in the synthesis of more complex molecules or as a functional material with specific properties.

In conclusion, 1-(3,4-Methylenedioxyphenyl)-4,4-dimethyl-pent-1-en-3-one (CAS No. 2419-68-3) is a multifaceted compound with significant potential in various fields of research and application. Its anti-inflammatory, antioxidant, and anticancer properties make it an attractive target for drug discovery efforts. Ongoing research continues to uncover new aspects of its biological activities and synthetic methodologies, further solidifying its importance in the scientific community.

2419-68-3 (1-(3,4-Methylenedioxyphenyl)-4,4-dimethyl-pent-1-en-3-one) Related Products

Recommended suppliers
Amadis Chemical Company Limited
(CAS:2419-68-3)1-(3,4-Methylenedioxyphenyl)-4,4-dimethyl-pent-1-en-3-one
A1008684
Purity:99%
Quantity:1g
Price ($):272.0
Email