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  • Benzene-1,4-diboronic acid-bis-MIDA ester

  • Benzene-1,4-diboronic acid-bis-MIDA ester

    Catalog Number
    ACMA00015354
    Product Name
    Benzene-1,4-diboronic acid-bis-MIDA ester
    Category
    Salt
    IUPAC Name
    6-methyl-2-[4-(6-methyl-4,8-dioxo-1,3,6,2-dioxazaborocan-2-yl)phenyl]-1,3,6,2-dioxazaborocane-4,8-dione
    Molecular Weight
    387.9g/mol
    Molecular Formula
    C16H18B2N2O8
    Canonical SMILES
    B1(OC(=O)CN(CC(=O)O1)C)C2=CC=C(C=C2)B3OC(=O)CN(CC(=O)O3)C
    InChI
    InChI=1S/C16H18B2N2O8/c1-19-7-13(21)25-17(26-14(22)8-19)11-3-5-12(6-4-11)18-27-15(23)9-20(2)10-16(24)28-18/h3-6H,7-10H2,1-2H3
    InChI Key
    WDGUCEFOPMPYPL-UHFFFAOYSA-N
    Complexity
    546
    Covalently-Bonded Unit Count
    1
    Exact Mass
    388.124926g/mol
    Formal Charge
    0
    Heavy Atom Count
    28
    Monoisotopic Mass
    388.124926g/mol
    Rotatable Bond Count
    2
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