Cas no 69696-37-3 (5-Bromo-2,4-dimethylpyrimidine)

5-Bromo-2,4-dimethylpyrimidine is a halogenated pyrimidine derivative widely used as a versatile intermediate in organic synthesis and pharmaceutical research. Its bromine substituent at the 5-position and methyl groups at the 2- and 4-positions enhance its reactivity, making it valuable for cross-coupling reactions, nucleophilic substitutions, and the preparation of more complex heterocyclic compounds. The compound exhibits high purity and stability, ensuring consistent performance in synthetic applications. Its structural features also make it useful in the development of agrochemicals, bioactive molecules, and materials science. The product is typically supplied with detailed analytical data (e.g., NMR, HPLC) to confirm quality and suitability for research or industrial use.
5-Bromo-2,4-dimethylpyrimidine structure
69696-37-3 structure
Product Name:5-Bromo-2,4-dimethylpyrimidine
CAS No:69696-37-3
MF:C6H7BrN2
MW:187.037180185318
MDL:MFCD13705449
CID:1038437
PubChem ID:12490579
Update Time:2025-05-22

5-Bromo-2,4-dimethylpyrimidine Chemical and Physical Properties

Names and Identifiers

    • 5-Bromo-2,4-dimethylpyrimidine
    • 5-Bromo-2,4-dimethyl-pyrimidine
    • Pyrimidine, 5-bromo-2,4-dimethyl-
    • 5-Bromo-2,6-dimethylpyrimidine
    • UITPCPFEEVHRRJ-UHFFFAOYSA-N
    • AB70482
    • AK100705
    • SY032161
    • ST2411761
    • X6083
    • MDL: MFCD13705449
    • Inchi: 1S/C6H7BrN2/c1-4-6(7)3-8-5(2)9-4/h3H,1-2H3
    • InChI Key: UITPCPFEEVHRRJ-UHFFFAOYSA-N
    • SMILES: BrC1=CN=C(C)N=C1C

Computed Properties

  • Exact Mass: 185.97900
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 9
  • Rotatable Bond Count: 0
  • Complexity: 97.1
  • Topological Polar Surface Area: 25.8

Experimental Properties

  • PSA: 25.78000
  • LogP: 1.85590

5-Bromo-2,4-dimethylpyrimidine Security Information

5-Bromo-2,4-dimethylpyrimidine Customs Data

  • HS CODE:2933599090
  • Customs Data:

    China Customs Code:

    2933599090

    Overview:

    2933599090. Other compounds with pyrimidine ring in structure(Including other compounds with piperazine ring on the structure. VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:6.5%. general tariff:20.0%

    Declaration elements:

    Product Name, component content, use to, Please indicate the appearance of Urotropine, 6- caprolactam please indicate the appearance, Signing date

    Summary:

    2933599090. other compounds containing a pyrimidine ring (whether or not hydrogenated) or piperazine ring in the structure. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

5-Bromo-2,4-dimethylpyrimidine Pricemore >>

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5-Bromo-2,4-dimethylpyrimidine Production Method

Additional information on 5-Bromo-2,4-dimethylpyrimidine

5-Bromo-2,4-Dimethylpyrimidine: A Comprehensive Overview

5-Bromo-2,4-Dimethylpyrimidine (CAS No. 69696-37-3) is a heterocyclic organic compound that belongs to the pyrimidine family. Pyrimidines are six-membered aromatic rings containing two nitrogen atoms at positions 1 and 3. The compound in question features bromine and methyl substituents at positions 5, 2, and 4, respectively. This structure imparts unique chemical properties that make it a subject of interest in various fields of research and application.

The synthesis of 5-Bromo-2,4-Dimethylpyrimidine typically involves multi-step reactions, often starting from simpler precursors like aldehydes or ketones. One common approach is the Biginelli reaction, which is a well-known method for synthesizing pyrimidones and related compounds. However, modifications to this reaction can lead to the formation of pyrimidines with various substituents. The presence of bromine in this compound suggests that bromination reactions or substitutions played a key role in its synthesis.

Recent studies have highlighted the potential of 5-Bromo-2,4-Dimethylpyrimidine in the field of medicinal chemistry. Researchers have explored its role as a building block for designing bioactive molecules with potential applications in drug discovery. For instance, derivatives of this compound have shown promise as inhibitors of certain enzymes associated with diseases such as cancer and neurodegenerative disorders.

In addition to its medicinal applications, 5-Bromo-2,4-Dimethylpyrimidine has also been investigated for its electronic properties. Pyrimidines are known for their ability to act as π-conjugated systems, which makes them suitable candidates for use in organic electronics. The bromine substituent in this compound can further modulate its electronic characteristics, making it a potential candidate for applications in organic light-emitting diodes (OLEDs) or solar cells.

The stability and reactivity of 5-Bromo-2,4-Dimethylpyrimidine are influenced by its substituents. The methyl groups at positions 2 and 4 provide steric hindrance, which can affect the reactivity of the molecule during various chemical transformations. On the other hand, the bromine atom at position 5 introduces electron-withdrawing effects, which can enhance the electrophilicity of the ring and facilitate certain types of reactions.

From an environmental perspective, understanding the degradation pathways of 5-Bromo-2,4-Dimethylpyrimidine is crucial for assessing its potential impact on ecosystems. Recent research has focused on identifying the microbial and enzymatic processes that can break down this compound into less harmful byproducts. Such studies are essential for developing sustainable methods of waste management and pollution control.

In conclusion, 5-Bromo-2,4-Dimethylpyrimidine (CAS No. 69696-37-3) is a versatile compound with a wide range of potential applications in medicine, materials science, and environmental chemistry. Its unique structure and properties continue to attract the attention of researchers worldwide. As new insights into its synthesis, reactivity, and applications emerge, this compound is likely to play an increasingly important role in both academic research and industrial development.

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