Cas no 1361834-91-4 (2',6'-Dichloro-4-fluoro-biphenyl-3-carbonitrile)

2',6'-Dichloro-4-fluoro-biphenyl-3-carbonitrile is a fluorinated biphenyl derivative featuring a nitrile functional group, making it a versatile intermediate in organic synthesis. Its distinct substitution pattern, with chlorine and fluorine atoms at strategic positions, enhances its reactivity and selectivity in cross-coupling reactions, such as Suzuki-Miyaura or Buchwald-Hartwig couplings. The electron-withdrawing nitrile group further contributes to its utility in constructing complex heterocyclic frameworks. This compound is particularly valuable in pharmaceutical and agrochemical research, where its structural motifs are often employed in the development of bioactive molecules. Its high purity and stability under standard conditions ensure reliable performance in synthetic applications.
2',6'-Dichloro-4-fluoro-biphenyl-3-carbonitrile structure
1361834-91-4 structure
Product Name:2',6'-Dichloro-4-fluoro-biphenyl-3-carbonitrile
CAS No:1361834-91-4
MF:C13H6Cl2FN
MW:266.097844600677
CID:4991675
Update Time:2025-06-08

2',6'-Dichloro-4-fluoro-biphenyl-3-carbonitrile Chemical and Physical Properties

Names and Identifiers

    • 2',6'-Dichloro-4-fluoro-biphenyl-3-carbonitrile
    • Inchi: 1S/C13H6Cl2FN/c14-10-2-1-3-11(15)13(10)8-4-5-12(16)9(6-8)7-17/h1-6H
    • InChI Key: YMSFSLPLORXABK-UHFFFAOYSA-N
    • SMILES: ClC1C=CC=C(C=1C1C=CC(=C(C#N)C=1)F)Cl

Computed Properties

  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 17
  • Rotatable Bond Count: 1
  • Complexity: 304
  • XLogP3: 4.6
  • Topological Polar Surface Area: 23.8

2',6'-Dichloro-4-fluoro-biphenyl-3-carbonitrile Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
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