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  • 3-(2-Propynylaminocarbonyl)phenylboronic acid pinacol ester

  • 3-(2-Propynylaminocarbonyl)phenylboronic acid pinacol ester

    Catalog Number
    ACMA00014894
    Product Name
    3-(2-Propynylaminocarbonyl)phenylboronic acid pinacol ester
    Category
    Salt
    IUPAC Name
    N-prop-2-ynyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzamide
    Molecular Weight
    285.1g/mol
    Molecular Formula
    C16H20BNO3
    Canonical SMILES
    B1(OC(C(O1)(C)C)(C)C)C2=CC(=CC=C2)C(=O)NCC#C
    InChI
    InChI=1S/C16H20BNO3/c1-6-10-18-14(19)12-8-7-9-13(11-12)17-20-15(2,3)16(4,5)21-17/h1,7-9,11H,10H2,2-5H3,(H,18,19)
    InChI Key
    BJJVNRNPHMBKSF-UHFFFAOYSA-N
    Complexity
    436
    Covalently-Bonded Unit Count
    1
    Exact Mass
    285.153624g/mol
    Formal Charge
    0
    Heavy Atom Count
    21
    Monoisotopic Mass
    285.153624g/mol
    Rotatable Bond Count
    3
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