Cas no 361465-18-1 (3-(3-Bromobenzyl)oxy-4-methoxybenzaldehyde)

3-(3-Bromobenzyl)oxy-4-methoxybenzaldehyde is a brominated aromatic aldehyde derivative with a benzyl ether linkage, offering versatile reactivity in organic synthesis. Its structure combines a formyl group with methoxy and bromobenzyloxy substituents, making it a valuable intermediate for constructing complex molecules, particularly in pharmaceutical and agrochemical applications. The bromine atom enhances its utility in cross-coupling reactions, such as Suzuki or Heck couplings, while the aldehyde functionality allows for further derivatization via condensation or reduction. The methoxy group contributes to electron-donating effects, influencing reactivity patterns. This compound is characterized by high purity and stability, ensuring reliable performance in synthetic workflows.
3-(3-Bromobenzyl)oxy-4-methoxybenzaldehyde structure
361465-18-1 structure
Product Name:3-(3-Bromobenzyl)oxy-4-methoxybenzaldehyde
CAS No:361465-18-1
MF:C15H13BrO3
MW:321.165923833847
MDL:MFCD02647958
CID:3046754
PubChem ID:2975606
Update Time:2025-05-20

3-(3-Bromobenzyl)oxy-4-methoxybenzaldehyde Chemical and Physical Properties

Names and Identifiers

    • 3-[(3-Bromobenzyl)oxy]-4-methoxybenzaldehyde
    • SR-01000296034
    • STK501233
    • 3-((3-Bromobenzyl)oxy)-4-methoxybenzaldehyde
    • SR-01000296034-1
    • ALBB-001309
    • AKOS000178757
    • 3-[(3-bromophenyl)methoxy]-4-methoxybenzaldehyde
    • CS-0317957
    • VS-14010
    • 3-[(3-Bromobenzyl)oxy]-4-methoxybenzaldehyde, AldrichCPR
    • 361465-18-1
    • MFCD02647958
    • BBL037225
    • H21397
    • 3-(3-Bromobenzyl)oxy-4-methoxybenzaldehyde
    • MDL: MFCD02647958
    • Inchi: 1S/C15H13BrO3/c1-18-14-6-5-11(9-17)8-15(14)19-10-12-3-2-4-13(16)7-12/h2-9H,10H2,1H3
    • InChI Key: BAKPSEHMBJUBAJ-UHFFFAOYSA-N
    • SMILES: BrC1=CC=CC(=C1)COC1C=C(C=O)C=CC=1OC

Computed Properties

  • Exact Mass: 320.00481g/mol
  • Monoisotopic Mass: 320.00481g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 19
  • Rotatable Bond Count: 5
  • Complexity: 285
  • 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: 3.5
  • Topological Polar Surface Area: 35.5?2

3-(3-Bromobenzyl)oxy-4-methoxybenzaldehyde Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
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3-[(3-Bromobenzyl)oxy]-4-methoxybenzaldehyde
361465-18-1
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$ 185.00 2022-06-07
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abcr
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3-[(3-Bromobenzyl)oxy]-4-methoxybenzaldehyde
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Additional information on 3-(3-Bromobenzyl)oxy-4-methoxybenzaldehyde

Comprehensive Analysis of 3-(3-Bromobenzyl)oxy-4-methoxybenzaldehyde (CAS No. 361465-18-1): Properties, Applications, and Industry Trends

3-(3-Bromobenzyl)oxy-4-methoxybenzaldehyde (CAS No. 361465-18-1) is a specialized organic compound gaining attention in pharmaceutical and material science research. This brominated benzaldehyde derivative features a unique molecular structure combining a methoxybenzaldehyde core with a 3-bromobenzyl ether group, making it valuable for synthetic applications. Researchers frequently search for "3-(3-Bromobenzyl)oxy-4-methoxybenzaldehyde synthesis" or "CAS 361465-18-1 suppliers," reflecting its growing commercial importance.

The compound's electrophilic aldehyde group and aromatic bromine substituent enable diverse chemical transformations, particularly in constructing complex heterocycles. Recent publications highlight its role in developing fluorescent probes and photoactive materials, aligning with the surge in demand for organic electronics. Analytical data shows increasing searches for "3-(3-Bromobenzyl)oxy-4-methoxybenzaldehyde NMR spectrum" and "HPLC purification methods," indicating robust academic interest.

From a commercial perspective, 361465-18-1 serves as a key intermediate in medicinal chemistry, especially for kinase inhibitor development. Its lipophilic nature and hydrogen-bonding capacity make it suitable for drug discovery programs targeting protein-protein interactions. Industry reports note rising queries about "scale-up production" and "regioselective bromination techniques," reflecting manufacturing challenges.

Environmental and regulatory aspects of 3-(3-Bromobenzyl)oxy-4-methoxybenzaldehyde comply with major chemical inventories (REACH, TSCA). The compound's stability profile and low ecotoxicity make it preferable to heavier halogenated analogs, addressing sustainability concerns in green chemistry initiatives. Search trends reveal growing interest in "biodegradable benzaldehyde derivatives" and "halogenated compound alternatives."

Advanced characterization studies using X-ray crystallography and DFT calculations have elucidated the compound's conformational preferences, important for rational drug design. The crystal packing of 361465-18-1 shows interesting π-π stacking interactions, relevant to materials science applications. Researchers increasingly seek "solid-state properties" and "polymorphism studies" related to this compound.

In analytical chemistry, 3-(3-Bromobenzyl)oxy-4-methoxybenzaldehyde serves as a chromatographic standard for method development. Its distinct UV absorption maxima at 254 nm and 310 nm facilitate detection in complex matrices. Laboratory professionals frequently inquire about "HPLC retention time" and "mass spectrometry fragmentation patterns" for this analyte.

The future outlook for CAS 361465-18-1 appears promising, particularly in catalysis research and functional material synthesis. Emerging applications in metal-organic frameworks (MOFs) and covalent organic polymers (COPs) demonstrate its versatility. Patent analysis reveals growing IP activity around "bromobenzyl ether derivatives" and "methoxybenzaldehyde applications," signaling continued commercial relevance.

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