Cas no 191602-84-3 (3-Bromo-4-isopropoxybenzaldehyde)

3-Bromo-4-isopropoxybenzaldehyde is a versatile aromatic aldehyde featuring both bromo and isopropoxy functional groups, making it a valuable intermediate in organic synthesis. Its distinct substitution pattern allows for selective reactivity in cross-coupling reactions, such as Suzuki or Heck couplings, as well as further functionalization of the aldehyde group. The compound is particularly useful in pharmaceutical and agrochemical research, where it serves as a precursor for heterocyclic compounds and complex molecular frameworks. Its stability under standard conditions and well-defined reactivity profile enhance its utility in multistep synthetic routes. The product is typically supplied with high purity to ensure consistent performance in demanding applications.
3-Bromo-4-isopropoxybenzaldehyde structure
191602-84-3 structure
Product Name:3-Bromo-4-isopropoxybenzaldehyde
CAS No:191602-84-3
MF:C10H11BrO2
MW:243.097142457962
MDL:MFCD02629653
CID:878625
PubChem ID:3832843
Update Time:2025-10-17

3-Bromo-4-isopropoxybenzaldehyde Chemical and Physical Properties

Names and Identifiers

    • 3-Bromo-4-isopropoxybenzaldehyde
    • 3-bromo-4-propan-2-yloxybenzaldehyde
    • CHEMBRDG-BB 6451701
    • 3-bromo-4-(propan-2-yloxy)benzaldehyde
    • Benzaldehyde, 3-bromo-4-(1-methylethoxy)-
    • 3-bromo-4-isopropoxybenzaldehyde(SALTDATA: FREE)
    • CS-0196353
    • 191602-84-3
    • AKOS000297867
    • DA-08746
    • STL385234
    • QKKWLPJYKNZGRV-UHFFFAOYSA-N
    • BBL034346
    • SCHEMBL3631166
    • DTXSID90397057
    • MFCD02629653
    • AS-37254
    • MDL: MFCD02629653
    • Inchi: 1S/C10H11BrO2/c1-7(2)13-10-4-3-8(6-12)5-9(10)11/h3-7H,1-2H3
    • InChI Key: QKKWLPJYKNZGRV-UHFFFAOYSA-N
    • SMILES: BrC1C=C(C=O)C=CC=1OC(C)C

Computed Properties

  • Exact Mass: 241.99400
  • Monoisotopic Mass: 241.994
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 3
  • Complexity: 170
  • 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
  • Topological Polar Surface Area: 26.3A^2
  • XLogP3: 2.8

Experimental Properties

  • Density: 1.391
  • Boiling Point: 310.7°C at 760 mmHg
  • Flash Point: 141.7°C
  • Refractive Index: 1.561
  • PSA: 26.30000
  • LogP: 3.04880

3-Bromo-4-isopropoxybenzaldehyde Customs Data

  • HS CODE:2913000090
  • Customs Data:

    China Customs Code:

    2913000090

    Overview:

    2913000090 Item2912Other derivatives of the listed products [refer to halogenation,sulfonation,Nitrosative or nitrosative derivatives]. VAT:17.0% Tax refund rate:9.0% Regulatory conditions:nothing MFN tariff:5.5% general tariff:30.0%

    Declaration elements:

    Product Name, component content, use to

    Summary:

    HS: 2913000090 halogenated, sulphonated, nitrated or nitrosated derivatives of products of heading 2912 Educational tariff:17.0% Tax rebate rate:9.0% Regulatory conditions:none Most favored nation tariff:5.5% General tariff:30.0%

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3-Bromo-4-isopropoxybenzaldehyde Suppliers

Amadis Chemical Company Limited
Gold Member
Audited Supplier Audited Supplier
(CAS:191602-84-3)3-Bromo-4-isopropoxybenzaldehyde
Order Number:A880367
Stock Status:in Stock
Quantity:5g
Purity:99%
Pricing Information Last Updated:Friday, 30 August 2024 11:00
Price ($):227.0

Additional information on 3-Bromo-4-isopropoxybenzaldehyde

3-Bromo-4-isopropoxybenzaldehyde (CAS No. 191602-84-3)

3-Bromo-4-isopropoxybenzaldehyde, also known as 3-bromo-4-isopropoxybenzaldehyde and referenced by its CAS number 191602-84-3, is a significant organic compound in the field of chemistry. This compound belongs to the class of aromatic aldehydes, characterized by the presence of a benzene ring with substituents at the 3 and 4 positions. The substituents are a bromine atom and an isopropoxy group, respectively, which contribute to its unique chemical properties and reactivity.

The synthesis of 3-bromo-4-isopropoxybenzaldehyde typically involves multi-step organic reactions, often starting from benzaldehyde derivatives. The introduction of the bromine atom and the isopropoxy group requires careful control of reaction conditions to ensure high purity and yield. Recent advancements in catalytic methods have enabled more efficient syntheses, reducing production costs and enhancing scalability for industrial applications.

In terms of physical properties, 3-bromo-4-isopropoxybenzaldehyde is a crystalline solid with a melting point around 70°C. Its solubility in common organic solvents such as dichloromethane and ethyl acetate makes it suitable for various laboratory techniques, including chromatography and spectroscopy. The compound exhibits strong UV absorption due to its conjugated aromatic system, which is advantageous in applications involving light sensitivity.

The chemical reactivity of 3-bromo-4-isopropoxybenzaldehyde is influenced by the electron-withdrawing effects of the bromine atom and the electron-donating effects of the isopropoxy group. These opposing effects create a dynamic balance that modulates the compound's reactivity towards nucleophilic and electrophilic attacks. Recent studies have explored its use in cross-coupling reactions, such as Suzuki-Miyaura coupling, where it serves as an efficient coupling partner due to its activated aryl bromide moiety.

3-Bromo-4-isopropoxybenzaldehyde finds applications in diverse fields, including pharmaceuticals, agrochemicals, and materials science. In drug discovery, it has been utilized as a building block for constructing bioactive molecules targeting various disease states. For instance, researchers have reported its incorporation into scaffolds designed for kinase inhibitors, demonstrating potential therapeutic benefits.

In the realm of materials science, 3-bromo-4-isopropoxybenzaldehyde has been employed in the synthesis of advanced polymers and optoelectronic materials. Its ability to undergo controlled polymerization under specific conditions has led to the development of novel materials with tailored electronic properties.

The latest research on 3-bromo-4-isopropoxybenzaldehyde has focused on its role in green chemistry initiatives. Scientists have explored its use in catalytic cycles that minimize waste generation and improve atom economy. These efforts align with global sustainability goals by promoting environmentally friendly chemical processes.

In conclusion, 3-bromo-4-isopropoxybenzaldehyde (CAS No. 191602-84-3) stands out as a versatile compound with significant potential across multiple disciplines. Its unique chemical properties, combined with ongoing innovations in synthetic methodologies and application development, ensure its continued relevance in both academic research and industrial practices.

Recommended suppliers
Amadis Chemical Company Limited
(CAS:191602-84-3)3-Bromo-4-isopropoxybenzaldehyde
A880367
Purity:99%
Quantity:5g
Price ($):227.0
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