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  • 1-(Ethoxycarbonylmethyl)-1H-pyrazole-4-boronic acid, pinacol ester

  • 1-(Ethoxycarbonylmethyl)-1H-pyrazole-4-boronic acid, pinacol ester

    Catalog Number
    ACM864754165-1
    CAS Number
    864754-16-5
    Product Name
    1-(Ethoxycarbonylmethyl)-1H-pyrazole-4-boronic acid, pinacol ester
    Structure
    Category
    Salt
    IUPAC Name
    ethyl 2-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazol-1-yl]acetate
    Molecular Weight
    280.13g/mol
    Molecular Formula
    C13H21BN2O4
    Canonical SMILES
    B1(OC(C(O1)(C)C)(C)C)C2=CN(N=C2)CC(=O)OCC
    InChI
    InChI=1S/C13H21BN2O4/c1-6-18-11(17)9-16-8-10(7-15-16)14-19-12(2,3)13(4,5)20-14/h7-8H,6,9H2,1-5H3
    InChI Key
    YUEZJHOSHBTWPV-UHFFFAOYSA-N
    Complexity
    359
    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
    5
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