Cas no 7645-95-6 ((2E)-3-(2-Hydroxyphenyl)-1-(4-methylphenyl)prop-2-en-1-one)

(2E)-3-(2-Hydroxyphenyl)-1-(4-methylphenyl)prop-2-en-1-one is a chalcone derivative characterized by its α,β-unsaturated ketone structure with hydroxyl and methyl substituents. This compound exhibits notable photophysical and chemical reactivity due to its conjugated system, making it useful in organic synthesis and material science applications. Its hydroxyl group enhances solubility in polar solvents and provides a site for further functionalization, while the methylphenyl moiety contributes to stability. The compound’s extended π-conjugation also suggests potential in optoelectronic research. Its well-defined structure allows for precise modifications, facilitating studies in molecular design, catalysis, and bioactive compound development. Purity and reproducibility are key advantages for research applications.
(2E)-3-(2-Hydroxyphenyl)-1-(4-methylphenyl)prop-2-en-1-one structure
7645-95-6 structure
Product Name:(2E)-3-(2-Hydroxyphenyl)-1-(4-methylphenyl)prop-2-en-1-one
CAS No:7645-95-6
MF:C16H14O2
MW:238.281164646149
CID:580343
PubChem ID:5383463
Update Time:2025-05-26

(2E)-3-(2-Hydroxyphenyl)-1-(4-methylphenyl)prop-2-en-1-one Chemical and Physical Properties

Names and Identifiers

    • 2-Propen-1-one,3-(2-hydroxyphenyl)-1-(4-methylphenyl)-
    • (2E)-3-(2-Hydroxyphenyl)-1-(4-methylphenyl)prop-2-en-1-one
    • trans-3-(2-hydroxyphenyl)-1-p-tolylprop-2-en-1-one
    • (E)-3-(2-hydroxyphenyl)-1-(4-methylphenyl)-2-propen-1-one
    • (E)-3-(2-hydroxyphenyl)-1-p-tolylprop-2-en-1-one
    • (E)-3-(2-hydroxyphenyl)-1-p-tolylprop-2-en-1-one, 2-hydroxy-4'-methylchalcone
    • 2'-Hydroxy-4-methylchalcon
    • 2-hydroxy-4'-methylchalcone
    • 2-hydroxy-4'-methyl-trans-chalcone
    • 2-Hydroxy-4'-methyl-trans-chalkon
    • SCHEMBL5084329
    • SCHEMBL5084324
    • 3-(2-hydroxyphenyl)-1-(4-methylphenyl)-2-propen-1-one
    • Z56755769
    • AKOS001025443
    • (E)-3-(2-hydroxyphenyl)-1-(4-methylphenyl)prop-2-en-1-one
    • 7645-95-6
    • NSC170283
    • NSC-170283
    • NSC139719
    • BS-3358
    • DTXSID20419372
    • 81226-96-2
    • NSC-139719
    • 3-(2-hydroxyphenyl)-1-(4-methylphenyl)prop-2-en-1-one
    • Inchi： 1S/C16H14O2/c1-12-6-8-14(9-7-12)16(18)11-10-13-4-2-3-5-15(13)17/h2-11,17H,1H3/b11-10+
    • InChI Key： WWNBWYJVZCFWRS-ZHACJKMWSA-N
    • SMILES： OC1C=CC=CC=1/C=C/C(C1C=CC(C)=CC=1)=O

Computed Properties

  • Exact Mass: 238.09900
  • Monoisotopic Mass: 238.099379685g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 18
  • Rotatable Bond Count: 3
  • Complexity: 300
  • 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: 3.7
  • Topological Polar Surface Area: 37.3?2

Experimental Properties

  • PSA: 37.30000
  • LogP: 3.59670

(2E)-3-(2-Hydroxyphenyl)-1-(4-methylphenyl)prop-2-en-1-one Customs Data

  • HS CODE：2914501900
  • Customs Data：

    China Customs Code:

    2914501900

    Overview:

    2914501900 Other ketophenols.Regulatory conditions:nothing.VAT:17.0%.Tax refund rate:9.0%.MFN tariff:5.5%.general tariff:30.0%

    Declaration elements:

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

    Summary:

    2914501900 other ketone-phenols.Supervision conditions:None.VAT:17.0%.Tax rebate rate:9.0%.MFN tariff:5.5%.General tariff:30.0%

(2E)-3-(2-Hydroxyphenyl)-1-(4-methylphenyl)prop-2-en-1-one Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
TRC
E108730-50mg
(2E)-3-(2-Hydroxyphenyl)-1-(4-methylphenyl)prop-2-en-1-one
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 $ 205.00 2022-06-05
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 ￡245.00 2023-09-02
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 7645-95-6 >97%
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 ￡37.00 2025-02-08
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BS-3358-10MG
(2E)-3-(2-hydroxyphenyl)-1-(4-methylphenyl)prop-2-en-1-one
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BS-3358-100MG
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(2E)-3-(2-Hydroxyphenyl)-1-(4-methylphenyl)prop-2-en-1-one Related Literature

Related Categories

Additional information on (2E)-3-(2-Hydroxyphenyl)-1-(4-methylphenyl)prop-2-en-1-one

Recent Advances in the Study of (2E)-3-(2-Hydroxyphenyl)-1-(4-methylphenyl)prop-2-en-1-one (CAS: 7645-95-6)

The compound (2E)-3-(2-Hydroxyphenyl)-1-(4-methylphenyl)prop-2-en-1-one, with the CAS number 7645-95-6, has recently garnered significant attention in the field of chemical biology and medicinal chemistry. This chalcone derivative is known for its diverse biological activities, including anti-inflammatory, antioxidant, and anticancer properties. Recent studies have focused on elucidating its molecular mechanisms, optimizing its synthesis, and exploring its potential therapeutic applications.

One of the key findings in recent research is the compound's ability to modulate key signaling pathways involved in inflammation and cancer progression. For instance, a 2023 study published in the Journal of Medicinal Chemistry demonstrated that (2E)-3-(2-Hydroxyphenyl)-1-(4-methylphenyl)prop-2-en-1-one effectively inhibits the NF-κB pathway, thereby reducing the production of pro-inflammatory cytokines. This suggests its potential as a lead compound for developing novel anti-inflammatory agents.

In addition to its anti-inflammatory effects, the compound has shown promising anticancer activity. A recent in vitro study conducted by researchers at the University of Cambridge revealed that it induces apoptosis in various cancer cell lines, including breast and colon cancer, through the activation of the intrinsic apoptotic pathway. The study also highlighted its selectivity towards cancer cells, sparing normal cells, which is a crucial advantage for potential therapeutic applications.

Another area of interest is the optimization of the compound's synthesis. A 2024 paper in Organic & Biomolecular Chemistry described a novel, high-yield synthetic route for (2E)-3-(2-Hydroxyphenyl)-1-(4-methylphenyl)prop-2-en-1-one, which utilizes green chemistry principles to minimize environmental impact. This advancement is expected to facilitate further research and potential scale-up for clinical trials.

Despite these promising findings, challenges remain. The compound's pharmacokinetic properties, such as bioavailability and metabolic stability, need further investigation. Recent studies have begun to address these issues by exploring various formulation strategies, including nanoparticle-based delivery systems, to enhance its therapeutic efficacy.

In conclusion, (2E)-3-(2-Hydroxyphenyl)-1-(4-methylphenyl)prop-2-en-1-one (CAS: 7645-95-6) represents a promising candidate for drug development, with its multifaceted biological activities and recent advancements in synthesis and mechanistic understanding. Future research should focus on translational studies to evaluate its safety and efficacy in preclinical and clinical settings.

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