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  • 5-Bromo-2-benzofuranboronic acid MIDA ester

  • 5-Bromo-2-benzofuranboronic acid MIDA ester

    Catalog Number
    ACMA00015435
    Product Name
    5-Bromo-2-benzofuranboronic acid MIDA ester
    Category
    Salt
    IUPAC Name
    1-(5-bromo-1-benzofuran-2-yl)-5-methyl-2,8-dioxa-5-azonia-1-boranuidabicyclo[3.3.0]octane-3,7-dione
    Molecular Weight
    351.95g/mol
    Molecular Formula
    C13H11BBrNO5
    Canonical SMILES
    [B-]12([N+](CC(=O)O1)(CC(=O)O2)C)C3=CC4=C(O3)C=CC(=C4)Br
    InChI
    InChI=1S/C13H11BBrNO5/c1-16-6-12(17)20-14(16,21-13(18)7-16)11-5-8-4-9(15)2-3-10(8)19-11/h2-5H,6-7H2,1H3
    InChI Key
    ZNACQWWAWVGCRP-UHFFFAOYSA-N
    Complexity
    495
    Covalently-Bonded Unit Count
    1
    Exact Mass
    350.99137g/mol
    Formal Charge
    0
    Heavy Atom Count
    21
    Monoisotopic Mass
    350.99137g/mol
    Rotatable Bond Count
    1
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