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  • 3-((2'-Chloro-5'-(trifluoromethyl)phenoxy)methyl)phenylboronic acid

  • 3-((2'-Chloro-5'-(trifluoromethyl)phenoxy)methyl)phenylboronic acid

    Catalog Number
    ACM871126259-1
    CAS Number
    871126-25-9
    Product Name
    3-((2'-Chloro-5'-(trifluoromethyl)phenoxy)methyl)phenylboronic acid
    Structure
    Category
    Salt
    IUPAC Name
    [3-[[2-chloro-5-(trifluoromethyl)phenoxy]methyl]phenyl]boronic acid
    Molecular Weight
    330.49g/mol
    Molecular Formula
    C14H11BClF3O3
    Canonical SMILES
    B(C1=CC(=CC=C1)COC2=C(C=CC(=C2)C(F)(F)F)Cl)(O)O
    InChI
    InChI=1S/C14H11BClF3O3/c16-12-5-4-10(14(17,18)19)7-13(12)22-8-9-2-1-3-11(6-9)15(20)21/h1-7,20-21H,8H2
    InChI Key
    IRBNKOHBJCGIFU-UHFFFAOYSA-N
    Complexity
    357
    Covalently-Bonded Unit Count
    1
    Exact Mass
    330.044187g/mol
    Formal Charge
    0
    Heavy Atom Count
    22
    Monoisotopic Mass
    330.044187g/mol
    Rotatable Bond Count
    4
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