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  • 2-Pyridineboronic acid N-phenyldiethanolamine ester

  • 2-Pyridineboronic acid N-phenyldiethanolamine ester

    Catalog Number
    ACM662138967
    CAS Number
    662138-96-7
    Product Name
    2-Pyridineboronic acid N-phenyldiethanolamine ester
    Structure
    Category
    Salt
    IUPAC Name
    6-phenyl-2-pyridin-2-yl-1,3,6,2-dioxazaborocane
    Molecular Weight
    268.12g/mol
    Molecular Formula
    C15H17BN2O2
    Canonical SMILES
    B1(OCCN(CCO1)C2=CC=CC=C2)C3=CC=CC=N3
    InChI
    InChI=1S/C15H17BN2O2/c1-2-6-14(7-3-1)18-10-12-19-16(20-13-11-18)15-8-4-5-9-17-15/h1-9H,10-13H2
    InChI Key
    QDIQDVHNUYDVDD-UHFFFAOYSA-N
    Complexity
    277
    Covalently-Bonded Unit Count
    1
    Exact Mass
    268.138308g/mol
    Formal Charge
    0
    Heavy Atom Count
    20
    Monoisotopic Mass
    268.138308g/mol
    Rotatable Bond Count
    2
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