Cas no 627526-35-6 (1,3,2-Dioxaborolane, 2-(4-fluoro-1-naphthalenyl)-4,4,5,5-tetramethyl-)

1,3,2-Dioxaborolane, 2-(4-fluoro-1-naphthalenyl)-4,4,5,5-tetramethyl-, is a fluorinated naphthalene-derived boronic ester commonly employed in Suzuki-Miyaura cross-coupling reactions. Its key advantages include enhanced stability under typical reaction conditions due to the tetramethyl substitution on the dioxaborolane ring, which minimizes protodeboronation. The 4-fluoro-naphthalenyl moiety offers improved electronic properties for selective coupling reactions, making it valuable in pharmaceutical and materials science applications. The compound’s crystalline nature facilitates handling and purification, while its well-defined reactivity profile ensures consistent performance in synthetic workflows. Suitable for use in both academic and industrial settings, it serves as a reliable intermediate for constructing complex fluorinated aromatic systems.
1,3,2-Dioxaborolane, 2-(4-fluoro-1-naphthalenyl)-4,4,5,5-tetramethyl- structure
627526-35-6 structure
Product Name:1,3,2-Dioxaborolane, 2-(4-fluoro-1-naphthalenyl)-4,4,5,5-tetramethyl-
CAS No:627526-35-6
MF:C16H18BFO2
MW:272.122328281403
MDL:MFCD11520119
CID:855201
PubChem ID:22240116
Update Time:2025-06-08

1,3,2-Dioxaborolane, 2-(4-fluoro-1-naphthalenyl)-4,4,5,5-tetramethyl- Chemical and Physical Properties

Names and Identifiers

    • 1,3,2-Dioxaborolane, 2-(4-fluoro-1-naphthalenyl)-4,4,5,5-tetramethyl-
    • 2-(1-FLUORONAPHTHALEN-4-YL)-4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLANE
    • 2-(4-Fluoronaphthalen-1-yl)-4,4,5,5-tetramethyl-[1,3,2]dioxaborolane
    • SCHEMBL5781133
    • 4-Fluoronaphthalene-1-boronic acid pinacol ester
    • JYOPNVFIMNCXRZ-UHFFFAOYSA-N
    • E87437
    • 2-(4-fluoro-naphthalen-1-yl)-4,4,5,5-tetramethyl-[1,3,2]dioxaborolane
    • 627526-35-6
    • CAB52635
    • AKOS017561895
    • MFCD11520119
    • CS-0189252
    • EN300-368482
    • 4-Fluoronaphtalene-1-boronic acid pinacol ester
    • DTXSID70623705
    • 2-(4-Fluoronaphthalen-1-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
    • MDL: MFCD11520119
    • Inchi: 1S/C16H18BFO2/c1-15(2)16(3,4)20-17(19-15)13-9-10-14(18)12-8-6-5-7-11(12)13/h5-10H,1-4H3
    • InChI Key: JYOPNVFIMNCXRZ-UHFFFAOYSA-N
    • SMILES: FC1=CC=C(B2OC(C)(C)C(C)(C)O2)C2C=CC=CC=21

Computed Properties

  • Exact Mass: 271.14204
  • Monoisotopic Mass: 272.1383881g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 20
  • Rotatable Bond Count: 1
  • Complexity: 356
  • 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: 18.5?2

Experimental Properties

  • PSA: 18.46

1,3,2-Dioxaborolane, 2-(4-fluoro-1-naphthalenyl)-4,4,5,5-tetramethyl- Security Information

1,3,2-Dioxaborolane, 2-(4-fluoro-1-naphthalenyl)-4,4,5,5-tetramethyl- Pricemore >>

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1,3,2-Dioxaborolane, 2-(4-fluoro-1-naphthalenyl)-4,4,5,5-tetramethyl- Related Literature

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