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  • 3-Nitrophenylboronic acid

  • 3-Nitrophenylboronic acid

    Catalog Number
    ACM13331276
    CAS Number
    13331-27-6
    Product Name
    3-Nitrophenylboronic acid
    Structure
    Category
    Salt
    Synonyms
    (3-nitrophenyl)-boronicaci;m-nitro-benzeneboronicaci;m-nitrobenzeneboronicacid;3-NITROPHENYLBORIC ACID;3-NITROPHENYLBORONIC ACID;3-NITROBENZENEBORONIC ACID;AKOS BRN-0128;M-NITROPHENYLBORONIC ACID
    IUPAC Name
    (3-nitrophenyl)boronic acid
    Molecular Weight
    166.93g/mol
    Molecular Formula
    C6H6BNO4
    Canonical SMILES
    B(C1=CC(=CC=C1)[N+](=O)[O-])(O)O
    InChI
    InChI=1S/C6H6BNO4/c9-7(10)5-2-1-3-6(4-5)8(11)12/h1-4,9-10H
    InChI Key
    ZNRGSYUVFVNSAW-UHFFFAOYSA-N
    Complexity
    169
    Covalently-Bonded Unit Count
    1
    Exact Mass
    167.038988g/mol
    Formal Charge
    0
    Heavy Atom Count
    12
    MeSH Entry Terms
    3-nitrobenzeneboronic acid;3-nitrophenylboronic acid;m-nitrobenzeneboronic acid;meta-nitrobenzeneboronic acid
    Monoisotopic Mass
    167.038988g/mol
    NSC Number
    401539;59739
    Rotatable Bond Count
    1
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