Cas no 81439-98-7 (Pyridinium, 4-(dimethylamino)-1-(phenylmethyl)-, bromide)

Pyridinium, 4-(dimethylamino)-1-(phenylmethyl)-, bromide is a quaternary ammonium compound featuring a pyridinium core substituted with a dimethylamino group at the 4-position and a benzyl group at the 1-position. This structure imparts cationic surfactant properties, making it useful in phase-transfer catalysis, organic synthesis, and as an antimicrobial agent. The bromide counterion enhances solubility in polar solvents, facilitating its application in aqueous and organic media. Its stability under mild conditions and ability to modify interfacial properties are key advantages. The compound is also employed in materials science for surface modification and in biochemical studies due to its interactions with biomolecules.
Pyridinium, 4-(dimethylamino)-1-(phenylmethyl)-, bromide structure
81439-98-7 structure
Product Name:Pyridinium, 4-(dimethylamino)-1-(phenylmethyl)-, bromide
CAS No:81439-98-7
MF:C14H17BrN2
MW:293.202182531357
CID:703922
PubChem ID:650664
Update Time:2025-06-12

Pyridinium, 4-(dimethylamino)-1-(phenylmethyl)-, bromide Chemical and Physical Properties

Names and Identifiers

    • Pyridinium, 4-(dimethylamino)-1-(phenylmethyl)-, bromide
    • 1-benzyl-N,N-dimethylpyridin-1-ium-4-amine,bromide
    • BDBM50556486
    • CHEMBL1508421
    • MLS000070144
    • SMR000009635
    • DTXSID60349508
    • HMS2303O08
    • 1-Benzyl-4-dimethylamino-pyridinium
    • 1-BENZYL-4-(DIMETHYLAMINO)PYRIDIN-1-IUM BROMIDE
    • 81439-98-7
    • 1-benzyl-N,N-dimethylpyridin-1-ium-4-amine;bromide
    • Inchi: 1S/C14H17N2.BrH/c1-15(2)14-8-10-16(11-9-14)12-13-6-4-3-5-7-13;/h3-11H,12H2,1-2H3;1H/q+1;/p-1
    • InChI Key: DLQQZLHDSORQJZ-UHFFFAOYSA-M
    • SMILES: [Br-].[N+]1(C=CC(=CC=1)N(C)C)CC1C=CC=CC=1

Computed Properties

  • Exact Mass: 292.05751g/mol
  • Monoisotopic Mass: 292.05751g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 17
  • Rotatable Bond Count: 3
  • Complexity: 189
  • Covalently-Bonded Unit Count: 2
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 7.1?2

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Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
1PlusChem
1P005L0P-25mg
Pyridinium, 4-(dimethylamino)-1-(phenylmethyl)-, bromide
81439-98-7
25mg
$671.00 2024-04-21

Additional information on Pyridinium, 4-(dimethylamino)-1-(phenylmethyl)-, bromide

Comprehensive Overview of Pyridinium, 4-(dimethylamino)-1-(phenylmethyl)-, bromide (CAS No. 81439-98-7)

Pyridinium, 4-(dimethylamino)-1-(phenylmethyl)-, bromide (CAS No. 81439-98-7) is a quaternary ammonium compound with a unique molecular structure that combines a pyridinium core with dimethylamino and benzyl functional groups. This compound has garnered significant attention in recent years due to its versatile applications in organic synthesis, material science, and pharmaceutical research. Researchers and industry professionals frequently search for terms like "Pyridinium bromide derivatives", "4-dimethylamino benzyl pyridinium bromide uses", and "CAS 81439-98-7 properties" to explore its potential.

The compound's structure features a positively charged pyridinium ring, which enhances its solubility in polar solvents and makes it an excellent candidate for catalytic reactions. The dimethylamino group at the 4-position contributes to its electron-donating properties, while the benzyl moiety provides steric bulk, influencing its reactivity in nucleophilic substitutions. These characteristics are often highlighted in searches such as "synthesis of quaternary ammonium salts" and "pyridinium-based catalysts", reflecting the growing interest in sustainable chemistry.

In the context of green chemistry, Pyridinium, 4-(dimethylamino)-1-(phenylmethyl)-, bromide has been investigated as a phase-transfer catalyst (PTC) for reactions under mild conditions. This aligns with the trending topic of "eco-friendly chemical processes", a frequent query among environmental scientists. Its ability to facilitate reactions in aqueous media reduces the need for volatile organic solvents, addressing concerns about "green solvent alternatives" and "reducing carbon footprint in labs".

Another area of interest is the compound's role in pharmaceutical intermediates. Searches like "pyridinium derivatives in drug discovery" and "CAS 81439-98-7 biological activity" indicate its relevance in medicinal chemistry. The dimethylamino group, in particular, is a common pharmacophore found in bioactive molecules, suggesting potential applications in designing new therapeutics. Recent studies have explored its use in "targeted drug delivery systems", a hot topic in precision medicine.

From a material science perspective, this compound's ionic nature makes it a candidate for "ionic liquids" and "electrolyte additives", keywords frequently associated with advancements in battery technology. Its thermal stability and conductivity properties are under investigation for next-generation energy storage solutions, resonating with searches like "high-performance battery materials".

Analytical chemists often inquire about "characterization techniques for quaternary ammonium compounds" when working with CAS No. 81439-98-7. Techniques such as NMR spectroscopy, mass spectrometry, and X-ray crystallography are essential for verifying its purity and structure, topics frequently discussed in academic forums.

In summary, Pyridinium, 4-(dimethylamino)-1-(phenylmethyl)-, bromide represents a multifaceted compound bridging diverse scientific disciplines. Its applications span from "green catalysis" to "pharmaceutical development", making it a subject of continuous exploration. As research trends evolve, so does the interest in this compound, as evidenced by rising searches for "innovative uses of pyridinium salts" and "CAS 81439-98-7 recent patents".

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