Cas no 16964-10-6 (3-(4-METHOXY-2-METHYLPHENYL)-1-PROPENE)

3-(4-Methoxy-2-methylphenyl)-1-propene is a substituted phenylpropene derivative characterized by its methoxy and methyl functional groups on the aromatic ring. This compound is of interest in organic synthesis due to its reactive propene side chain, which facilitates further functionalization through addition or coupling reactions. The electron-donating methoxy group enhances the aromatic ring's reactivity in electrophilic substitutions, while the methyl substituent influences steric and electronic properties. Its structural features make it a valuable intermediate in the preparation of fine chemicals, pharmaceuticals, and agrochemicals. The compound's stability and well-defined reactivity profile contribute to its utility in controlled synthetic applications.
3-(4-METHOXY-2-METHYLPHENYL)-1-PROPENE structure
16964-10-6 structure
Product Name:3-(4-METHOXY-2-METHYLPHENYL)-1-PROPENE
CAS No:16964-10-6
MF:C11H14O
MW:162.228263378143
MDL:MFCD07775075
CID:1005233
PubChem ID:19986999
Update Time:2025-05-23

3-(4-METHOXY-2-METHYLPHENYL)-1-PROPENE Chemical and Physical Properties

Names and Identifiers

    • 3-(4-METHOXY-2-METHYLPHENYL)-1-PROPENE
    • 3-Methyl-4-allyl-anisol
    • 3-methyl-4-allylanisole
    • 4-Allyl-3-methyl-anisol
    • 4-allyl-3-methylanisole
    • 5-Methoxy-1-methyl-2-allyl-benzol
    • Methyl-(3-methyl-4-allyl-phenyl)-aether
    • DTXSID80601690
    • SCHEMBL8964600
    • 1-allyl-4-methoxy-2-methylbenzene
    • DB-182744
    • 4-methoxy-2-methyl-1-prop-2-enylbenzene
    • MFCD07775075
    • AKOS006287309
    • 16964-10-6
    • 4-Methoxy-2-methyl-1-(prop-2-en-1-yl)benzene
    • MDL: MFCD07775075
    • Inchi: 1S/C11H14O/c1-4-5-10-6-7-11(12-3)8-9(10)2/h4,6-8H,1,5H2,2-3H3
    • InChI Key: UIZZSBQSGMWYKC-UHFFFAOYSA-N
    • SMILES: O(C)C1C=CC(CC=C)=C(C)C=1

Computed Properties

  • Exact Mass: 162.10400
  • Monoisotopic Mass: 162.104465066g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 3
  • Complexity: 142
  • 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: 3.3
  • Topological Polar Surface Area: 9.2?2

Experimental Properties

  • PSA: 9.23000
  • LogP: 2.73210

3-(4-METHOXY-2-METHYLPHENYL)-1-PROPENE Customs Data

  • HS CODE:2909309090
  • Customs Data:

    China Customs Code:

    2909309090

    Overview:

    2909309090 Other aromatic ethers and their halogenated derivatives\sulfonation\Nitrated derivative(Including nitrosative derivatives).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

    Summary:

    2909309090 other aromatic ethers and their halogenated, sulphonated, nitrated or nitrosated derivatives VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:5.5% General tariff:30.0%

3-(4-METHOXY-2-METHYLPHENYL)-1-PROPENE Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
TRC
M066005-250mg
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$ 255.00 2022-06-04
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$ 425.00 2022-06-04
abcr
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abcr
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abcr
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Additional information on 3-(4-METHOXY-2-METHYLPHENYL)-1-PROPENE

3-(4-METHOXY-2-METHYLPHENYL)-1-PROPENE: A Comprehensive Overview

3-(4-METHOXY-2-METHYLPHENYL)-1-PROPENE, also known by its CAS number 16964-10-6, is a compound of significant interest in the fields of organic chemistry and materials science. This compound is characterized by its unique structure, which combines a propene moiety with a substituted phenyl group. The phenyl group in question is substituted with both a methoxy and a methyl group, positioned at the 4 and 2 positions, respectively. This substitution pattern imparts distinctive electronic and steric properties to the molecule, making it a valuable component in various chemical reactions and applications.

The synthesis of 3-(4-METHOXY-2-METHYLPHENYL)-1-PROPENE typically involves the coupling of an appropriate aryl halide with a propene derivative. Recent advancements in catalytic methods, particularly those involving palladium-catalyzed cross-coupling reactions, have enabled more efficient and selective syntheses of this compound. These methods not only enhance the yield but also reduce the environmental footprint of the production process, aligning with current sustainability trends in chemistry.

One of the most notable applications of 3-(4-METHOXY-2-METHYLPHENYL)-1-PROPENE is in the field of polymer science. The compound serves as a monomer for the production of functional polymers, where its aromatic ring contributes to thermal stability and mechanical strength. Recent studies have explored its use in creating stimuli-responsive polymers, which can alter their properties in response to external stimuli such as temperature or light. These polymers hold promise for applications in drug delivery systems and smart materials.

In addition to its role in polymer synthesis, 3-(4-METHOXY-2-METHYLPHENYL)-1-PROPENE has been investigated for its potential in organic electronics. Its conjugated system allows for efficient charge transport, making it a candidate for use in organic light-emitting diodes (OLEDs) and photovoltaic devices. Researchers have reported enhanced electron mobility when this compound is incorporated into polymer blends, suggesting its utility in next-generation electronic materials.

The electronic properties of 3-(4-METHOXY-2-METHYLPHENYL)-1-PROPENE are further influenced by the substituents on the phenyl ring. The methoxy group introduces electron-donating effects, while the methyl group provides steric hindrance. These effects can be tuned to achieve desired electronic characteristics for specific applications. For instance, modifications to these substituents have been explored to optimize the compound's performance in nonlinear optical materials, which are critical for advanced optical communication systems.

The environmental impact of 3-(4-METHOXY-2-METHYLPHENYL)-1-PROPENE has also been a topic of recent research. Studies have focused on its biodegradability and potential toxicity to aquatic life. Preliminary findings suggest that under certain conditions, the compound can undergo microbial degradation, reducing its persistence in the environment. However, further investigations are required to fully understand its ecological footprint and ensure sustainable practices during its production and use.

In conclusion, 3-(4-METHOXY-2-METHYLPHENYL)-1-PROPENE, with its CAS number 16964-10-6, stands as a versatile compound with diverse applications across multiple disciplines. Its unique structure enables it to serve as a building block for advanced materials, while ongoing research continues to uncover new opportunities for its utilization. As scientific understanding deepens, this compound is poised to play an increasingly important role in shaping future technologies.

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