Cas no 1289132-07-5 (4-Bromo-2-isobutoxypyridine)

4-Bromo-2-isobutoxypyridine is a brominated pyridine derivative featuring an isobutoxy substituent at the 2-position. This compound serves as a versatile intermediate in organic synthesis, particularly in pharmaceutical and agrochemical applications. The bromine atom at the 4-position offers a reactive site for further functionalization via cross-coupling reactions, such as Suzuki or Buchwald-Hartwig couplings, enabling the construction of complex heterocyclic frameworks. The isobutoxy group enhances solubility in organic solvents, facilitating handling in synthetic workflows. Its stability under standard conditions and well-defined reactivity make it a valuable building block for researchers developing bioactive molecules or advanced materials. The compound is typically characterized by NMR and GC/MS for purity verification.
4-Bromo-2-isobutoxypyridine structure
4-Bromo-2-isobutoxypyridine structure
Product Name:4-Bromo-2-isobutoxypyridine
CAS No:1289132-07-5
MF:C9H12BrNO
MW:230.10168170929
CID:1033838
PubChem ID:71303274
Update Time:2025-10-13

4-Bromo-2-isobutoxypyridine Chemical and Physical Properties

Names and Identifiers

    • 4-Bromo-2-isobutoxypyridine
    • 4-bromo-2-(2-methylpropoxy)pyridine
    • J-514659
    • DTXSID90744865
    • KS-9666
    • AKOS016844667
    • SCHEMBL20918638
    • 1289132-07-5
    • DB-316318
    • MDL： MFCD22576253
    • Inchi： 1S/C9H12BrNO/c1-7(2)6-12-9-5-8(10)3-4-11-9/h3-5,7H,6H2,1-2H3
    • InChI Key： HMGVWECKFKGJDZ-UHFFFAOYSA-N
    • SMILES： BrC1C=CN=C(C=1)OCC(C)C

Computed Properties

  • Exact Mass: 229.01023g/mol
  • Monoisotopic Mass: 229.01023g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 3
  • Complexity: 130
  • 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: 3.2
  • Topological Polar Surface Area: 22.1?2

4-Bromo-2-isobutoxypyridine Pricemore >>

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