Cas no 342602-69-1 (3-bromo-5-(prop-2-en-1-yl)pyridine)

3-Bromo-5-(prop-2-en-1-yl)pyridine is a versatile brominated pyridine derivative featuring an allyl substituent at the 5-position. This compound serves as a valuable intermediate in organic synthesis, particularly in cross-coupling reactions such as Suzuki-Miyaura or Heck couplings, due to its reactive bromine and allyl functional groups. Its structure allows for further functionalization, making it useful in pharmaceutical and agrochemical research. The allyl group also offers potential for cyclization or polymerization applications. With high purity and stability under standard conditions, this compound is well-suited for use in method development and complex molecule construction. Proper handling under inert conditions is recommended to preserve reactivity.
3-bromo-5-(prop-2-en-1-yl)pyridine structure
342602-69-1 structure
Product Name:3-bromo-5-(prop-2-en-1-yl)pyridine
CAS No:342602-69-1
MF:C8H8BrN
MW:198.059821128845
CID:3944600
PubChem ID:11321547
Update Time:2025-11-01

3-bromo-5-(prop-2-en-1-yl)pyridine Chemical and Physical Properties

Names and Identifiers

    • Pyridine, 3-bromo-5-(2-propenyl)-
    • 3-allyl-5-bromopyridine
    • Pyridine, 3-bromo-5-(2-propen-1-yl)-
    • 3-bromo-5-(prop-2-en-1-yl)pyridine
    • 342602-69-1
    • LNIRDVCXPRIWDD-UHFFFAOYSA-N
    • SCHEMBL4805813
    • DA-06654
    • Inchi: 1S/C8H8BrN/c1-2-3-7-4-8(9)6-10-5-7/h2,4-6H,1,3H2
    • InChI Key: LNIRDVCXPRIWDD-UHFFFAOYSA-N
    • SMILES: C1=NC=C(CC=C)C=C1Br

Computed Properties

  • Exact Mass: 196.98401Da
  • Monoisotopic Mass: 196.98401Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 10
  • Rotatable Bond Count: 2
  • Complexity: 114
  • 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: 2.6
  • Topological Polar Surface Area: 12.9?2

3-bromo-5-(prop-2-en-1-yl)pyridine Pricemore >>

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