Cas no 1378667-59-4 (4-bromopyrimidine-2-carbaldehyde)

4-Bromopyrimidine-2-carbaldehyde is a versatile heterocyclic building block used in organic synthesis and pharmaceutical research. Its key advantages include a reactive aldehyde group and a bromine substituent, enabling selective functionalization at multiple sites. This compound is particularly valuable in cross-coupling reactions, nucleophilic substitutions, and as a precursor for pyrimidine derivatives. The electron-withdrawing nature of the bromine enhances the reactivity of the aldehyde, facilitating condensation and cyclization reactions. Its high purity and stability make it suitable for applications in medicinal chemistry, agrochemicals, and material science. The compound’s well-defined structure ensures reproducibility in synthetic pathways, supporting the development of complex molecular architectures.
4-bromopyrimidine-2-carbaldehyde structure
1378667-59-4 structure
Product Name:4-bromopyrimidine-2-carbaldehyde
CAS No:1378667-59-4
MF:C5H3BrN2O
MW:186.994119882584
CID:3163754
PubChem ID:118989529
Update Time:2025-07-27

4-bromopyrimidine-2-carbaldehyde Chemical and Physical Properties

Names and Identifiers

    • Not available
    • 4-bromopyrimidine-2-carbaldehyde
    • 4-Bromopyrimidine-2-carboxaldehyde
    • 1378667-59-4
    • AT45383
    • EN300-6507852
    • SB57692
    • Inchi: 1S/C5H3BrN2O/c6-4-1-2-7-5(3-9)8-4/h1-3H
    • InChI Key: QFFFJDCYFKUZEH-UHFFFAOYSA-N
    • SMILES: BrC1=CC=NC(C=O)=N1

Computed Properties

  • Exact Mass: 185.94288Da
  • Monoisotopic Mass: 185.94288Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 9
  • Rotatable Bond Count: 1
  • Complexity: 109
  • 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: 1
  • Topological Polar Surface Area: 42.9?2

4-bromopyrimidine-2-carbaldehyde Pricemore >>

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