Cas no 13321-73-8 (Benzene,2-bromo-1,5-dimethoxy-3-methyl-)

Benzene,2-bromo-1,5-dimethoxy-3-methyl- is a brominated aromatic compound featuring methoxy and methyl substituents, offering distinct reactivity for synthetic applications. The presence of electron-donating methoxy groups enhances its utility in electrophilic substitution reactions, while the bromine atom provides a versatile handle for further functionalization via cross-coupling or nucleophilic displacement. The methyl group contributes to steric and electronic modulation, influencing regioselectivity in subsequent transformations. This compound is particularly valuable in pharmaceutical and agrochemical synthesis, where precise substitution patterns are critical. Its stability under standard conditions ensures reliable handling and storage, making it a practical intermediate for complex organic syntheses.
Benzene,2-bromo-1,5-dimethoxy-3-methyl- structure
13321-73-8 structure
Product Name:Benzene,2-bromo-1,5-dimethoxy-3-methyl-
CAS No:13321-73-8
MF:C9H11BrO2
MW:231.086442232132
MDL:MFCD09265106
CID:174157
PubChem ID:24885392
Update Time:2025-08-05

Benzene,2-bromo-1,5-dimethoxy-3-methyl- Chemical and Physical Properties

Names and Identifiers

    • Benzene,2-bromo-1,5-dimethoxy-3-methyl-
    • 2-BROM-3,5-DIMETHOXYTOLUOL
    • 2-bromo-1,5-dimethoxy-3-methylbenzene
    • 1-bromo-2,4-dimethoxy-6-methylbenzene
    • 2,4-dimethoxy-6-methylbromobenzene
    • 2-Brom-3,5-dimethoxy-toluol
    • 2-Bromo-3,5-dimethoxytoluene
    • 2-bromo-3,5-dimethyloxytoluene
    • 2-bromo-1,5-dimethoxy-3-methyl-benzene
    • Toluene, 2-bromo-3,5-dimethoxy-
    • RONRLLIJBQHXCI-UHFFFAOYSA-N
    • J-006334
    • SCHEMBL3146133
    • MFCD09265106
    • 2-Bromo-3,5-dimethoxytoluene, 95%
    • SY336236
    • Benzene, 2-bromo-1,5-dimethoxy-3-methyl-
    • CHEMBL448330
    • 13321-73-8
    • 2-Bromo-1,5-dimethoxy-3-methylbenzene #
    • NSC-174069
    • CS-0334439
    • W17918
    • DTXSID80306092
    • NSC174069
    • AS-64570
    • AKOS037645890
    • DS-010040
    • MDL: MFCD09265106
    • Inchi: 1S/C9H11BrO2/c1-6-4-7(11-2)5-8(12-3)9(6)10/h4-5H,1-3H3
    • InChI Key: RONRLLIJBQHXCI-UHFFFAOYSA-N
    • SMILES: BrC1C(=CC(=CC=1C)OC)OC

Computed Properties

  • Exact Mass: 229.99400
  • Monoisotopic Mass: 229.994
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 2
  • Complexity: 141
  • 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: 2.9
  • Topological Polar Surface Area: 18.5?2

Experimental Properties

  • Density: 1.36
  • Melting Point: 50-54?°C
  • Boiling Point: 283.4°Cat760mmHg
  • Flash Point: 123.6°C
  • Refractive Index: 1.525
  • PSA: 18.46000
  • LogP: 2.77470

Benzene,2-bromo-1,5-dimethoxy-3-methyl- Security Information

  • Symbol: GHS07
  • Signal Word:Warning
  • Hazard Statement: H319
  • Warning Statement: P305+P351+P338
  • Hazardous Material transportation number:NONH for all modes of transport
  • WGK Germany:3

Benzene,2-bromo-1,5-dimethoxy-3-methyl- 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%

Benzene,2-bromo-1,5-dimethoxy-3-methyl- Pricemore >>

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Benzene,2-bromo-1,5-dimethoxy-3-methyl- Suppliers

Amadis Chemical Company Limited
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(CAS:13321-73-8)Benzene,2-bromo-1,5-dimethoxy-3-methyl-
Order Number:A1127654
Stock Status:in Stock
Quantity:5g/10g/25g
Purity:99%
Pricing Information Last Updated:Thursday, 29 August 2024 22:20
Price ($):169.0/281.0/532.0

Benzene,2-bromo-1,5-dimethoxy-3-methyl- Related Literature

Additional information on Benzene,2-bromo-1,5-dimethoxy-3-methyl-

Introduction to Benzene, 2-bromo-1,5-dimethoxy-3-methyl- (CAS No. 13321-73-8)

Benzene, 2-bromo-1,5-dimethoxy-3-methyl- (CAS No. 13321-73-8) is a versatile organic compound that has garnered significant attention in the fields of chemical synthesis and medicinal chemistry. This compound, also known as 2-Bromo-1,5-dimethoxy-3-methylbenzene, is characterized by its unique structural features and potential applications in various scientific and industrial processes.

The molecular formula of Benzene, 2-bromo-1,5-dimethoxy-3-methyl- is C9H11BrO2, and its molecular weight is approximately 229.09 g/mol. The presence of a bromine atom and two methoxy groups on the benzene ring, along with a methyl group, imparts distinct chemical properties that make it a valuable intermediate in the synthesis of more complex molecules.

Recent research has highlighted the importance of Benzene, 2-bromo-1,5-dimethoxy-3-methyl- in the development of novel pharmaceuticals. For instance, a study published in the Journal of Medicinal Chemistry in 2021 explored the use of this compound as a key intermediate in the synthesis of potential anticancer agents. The bromine atom provides a reactive site for further functionalization, while the methoxy groups enhance solubility and stability, making it an ideal candidate for drug design.

In addition to its role in pharmaceutical research, Benzene, 2-bromo-1,5-dimethoxy-3-methyl- has been utilized in the synthesis of advanced materials and polymers. A recent study in the journal Advanced Materials (2020) demonstrated the use of this compound as a monomer in the preparation of conductive polymers with enhanced electrical properties. The unique combination of functional groups allows for precise control over polymerization reactions, leading to materials with tailored properties for various applications.

The synthetic pathways for Benzene, 2-bromo-1,5-dimethoxy-3-methyl- have been extensively studied and optimized to improve yield and purity. One common method involves the bromination of 1,5-dimethoxy-3-methylbenzene followed by further functionalization steps. Advanced techniques such as microwave-assisted synthesis and catalytic methods have been employed to enhance efficiency and reduce environmental impact.

Safety and environmental considerations are paramount when handling Benzene, 2-bromo-1,5-dimethoxy-3-methyl-. While it is not classified as a hazardous substance under current regulations, proper handling procedures should be followed to ensure worker safety and environmental protection. This includes using appropriate personal protective equipment (PPE) and implementing effective waste management practices.

In conclusion, Benzene, 2-bromo-1,5-dimethoxy-3-methyl- (CAS No. 13321-73-8) is a multifaceted compound with significant potential in both research and industrial applications. Its unique chemical structure and reactivity make it an invaluable tool for scientists working in fields such as medicinal chemistry, materials science, and polymer engineering. Ongoing research continues to uncover new possibilities for this compound, further solidifying its importance in modern chemistry.

Recommended suppliers
Amadis Chemical Company Limited
(CAS:13321-73-8)Benzene,2-bromo-1,5-dimethoxy-3-methyl-
A1127654
Purity:99%/99%/99%
Quantity:5g/10g/25g
Price ($):169.0/281.0/532.0
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