Cas no 1310403-94-1 ((4-Ethoxy-2,6-difluorophenyl)boronic acid)

(4-Ethoxy-2,6-difluorophenyl)boronic acid is a boronic acid derivative featuring an ethoxy substituent at the para position and fluorine atoms at the ortho positions of the phenyl ring. This compound is widely employed in Suzuki-Miyaura cross-coupling reactions due to its stability and reactivity, enabling the synthesis of complex biaryl structures. The electron-withdrawing fluorine atoms enhance its electrophilic character, while the ethoxy group provides moderate steric and electronic effects, improving selectivity in coupling reactions. Its crystalline solid form ensures ease of handling and storage. This reagent is particularly valuable in pharmaceutical and agrochemical research for constructing fluorinated aromatic scaffolds with high precision.
(4-Ethoxy-2,6-difluorophenyl)boronic acid structure
1310403-94-1 structure
Product Name:(4-Ethoxy-2,6-difluorophenyl)boronic acid
CAS No:1310403-94-1
MF:C8H9BF2O3
MW:201.963069677353
MDL:MFCD12026735
CID:1036869
PubChem ID:44558122
Update Time:2025-06-07

(4-Ethoxy-2,6-difluorophenyl)boronic acid Chemical and Physical Properties

Names and Identifiers

    • (4-Ethoxy-2,6-difluorophenyl)boronic acid
    • 2,6-Difluoro-4-ethoxyphenylboronic acid
    • 4-Ethoxy-2,6-difluorophenylboronic acid
    • DB-010333
    • 2,6-Difluoro-4-ethoxyphenylboronicacid
    • MFCD12026735
    • (4-Ethoxy-2,6-difluoro-phenyl)boronic acid
    • SCHEMBL15872825
    • Boronic acid, B-(4-ethoxy-2,6-difluorophenyl)-
    • AKOS015838833
    • DS-15000
    • A888612
    • CS-0151485
    • 1310403-94-1
    • DTXSID20659357
    • MDL: MFCD12026735
    • Inchi: 1S/C8H9BF2O3/c1-2-14-5-3-6(10)8(9(12)13)7(11)4-5/h3-4,12-13H,2H2,1H3
    • InChI Key: MCHIBZJJQDCWMG-UHFFFAOYSA-N
    • SMILES: FC1C=C(C=C(C=1B(O)O)F)OCC

Computed Properties

  • Exact Mass: 202.06100
  • Monoisotopic Mass: 202.0612806g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 3
  • Complexity: 170
  • 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
  • Topological Polar Surface Area: 49.7?2

Experimental Properties

  • PSA: 49.69000
  • LogP: 0.04330

(4-Ethoxy-2,6-difluorophenyl)boronic acid Security Information

  • HazardClass:IRRITANT

(4-Ethoxy-2,6-difluorophenyl)boronic acid Pricemore >>

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