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  • 4-Bromo-2-fluorobenzoic acid

    • 4-Bromo-2-fluorobenzoic acid

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    Catalog Number
    ACM112704797
    CAS Number
    112704-79-7
    Product Name
    4-Bromo-2-fluorobenzoic acid
    Structure
    Category
    Liquid Crystal (LC) Building Blocks; Liquid Crystal (LC) Materials
    Synonyms
    Benzoic acid, 4-bromo-2-fluoro-
    IUPAC Name
    4-bromo-2-fluorobenzoic acid
    Molecular Weight
    219.01
    Molecular Formula
    C7H4BrFO2
    Canonical SMILES
    C1=CC(=C(C=C1Br)F)C(=O)O
    InChI
    InChI=1S/C7H4BrFO2/c8-4-1-2-5(7(10)11)6(9)3-4/h1-3H,(H,10,11)
    InChI Key
    ZQQSRVPOAHYHEL-UHFFFAOYSA-N
    Boiling Point
    289.4±25.0 ºC
    Melting Point
    211-215 ºC (lit.)
    Purity
    98%+
    Density
    1.721 g/ml
    Complexity
    163
    Covalently-Bonded Unit Count
    1
    Exact Mass
    217.93787g/mol
    Formal Charge
    0
    Heavy Atom Count
    11
    Monoisotopic Mass
    217.93787g/mol
    NSC Number
    190364
    Rotatable Bond Count
    1
    XLogP3
    3.1
    MSDS
    Download MSDS
    COA
    Download COA
    Spec Sheet
    Download Spec Sheet
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