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  • 1-[1,3]Dioxolan-2-ylmethyl-1H-pyrazole-4-boronic acid, pinacol ester

  • 1-[1,3]Dioxolan-2-ylmethyl-1H-pyrazole-4-boronic acid, pinacol ester

    Catalog Number
    ACMA00014943
    Product Name
    1-[1,3]Dioxolan-2-ylmethyl-1H-pyrazole-4-boronic acid, pinacol ester
    Category
    Salt
    IUPAC Name
    1-(1,3-dioxolan-2-ylmethyl)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazole
    Molecular Weight
    280.13g/mol
    Molecular Formula
    C13H21BN2O4
    Canonical SMILES
    B1(OC(C(O1)(C)C)(C)C)C2=CN(N=C2)CC3OCCO3
    InChI
    InChI=1S/C13H21BN2O4/c1-12(2)13(3,4)20-14(19-12)10-7-15-16(8-10)9-11-17-5-6-18-11/h7-8,11H,5-6,9H2,1-4H3
    InChI Key
    IWEGDQUCWQFKHS-UHFFFAOYSA-N
    Complexity
    344
    Covalently-Bonded Unit Count
    1
    Exact Mass
    280.159437g/mol
    Formal Charge
    0
    Heavy Atom Count
    20
    Monoisotopic Mass
    280.159437g/mol
    Rotatable Bond Count
    3
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