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  • 4-Carboxylphenylboronic acid pinacol ester

  • 4-Carboxylphenylboronic acid pinacol ester

    Catalog Number
    ACM180516874
    CAS Number
    180516-87-4
    Product Name
    4-Carboxylphenylboronic acid pinacol ester
    Structure
    Category
    Salt
    Synonyms
    4-CARBOXYBENZENEBORONIC ACID PINACOL CYCLIC ESTER;4-CARBOXYPHENYLBORONIC ACID PINACOLATE;4-CARBOXYPHENYLBORONIC ACID, PINACOL CYCLIC ESTER;4-CARBOXYPHENYLBORONIC ACID, PINACOL ESTER;4-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)BENZOIC ACID;[4-(4,4,5,5-T
    IUPAC Name
    4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoic acid
    Molecular Weight
    248.08g/mol
    Molecular Formula
    C13H17BO4
    Canonical SMILES
    B1(OC(C(O1)(C)C)(C)C)C2=CC=C(C=C2)C(=O)O
    InChI
    InChI=1S/C13H17BO4/c1-12(2)13(3,4)18-14(17-12)10-7-5-9(6-8-10)11(15)16/h5-8H,1-4H3,(H,15,16)
    InChI Key
    IYDKBQIEOBXLTP-UHFFFAOYSA-N
    Purity
    98%
    Complexity
    316
    Covalently-Bonded Unit Count
    1
    Exact Mass
    248.121989g/mol
    Formal Charge
    0
    Heavy Atom Count
    18
    Monoisotopic Mass
    248.121989g/mol
    Rotatable Bond Count
    2
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