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  • 4'-Bromobenzo-18-crown 6-Ether

    • 4'-Bromobenzo-18-crown 6-Ether

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    Catalog Number
    ACM75460285-1
    Product Name
    4'-Bromobenzo-18-crown 6-Ether
    Structure
    CAS
    75460-28-5
    Category
    Macrocycles
    IUPAC Name
    20-bromo-2,5,8,11,14,17-hexaoxabicyclo[16.4.0]docosa-1(18),19,21-triene
    Molecular Weight
    391.25g/mol
    Molecular Formula
    C16H23BrO6
    Canonical SMILES
    C1COCCOCCOC2=C(C=CC(=C2)Br)OCCOCCO1
    InChI
    InChI=1S/C16H23BrO6/c17-14-1-2-15-16(13-14)23-12-10-21-8-6-19-4-3-18-5-7-20-9-11-22-15/h1-2,13H,3-12H2
    InChI Key
    XHHZIFBFFGIFNI-UHFFFAOYSA-N
    Complexity
    294
    Covalently-Bonded Unit Count
    1
    Exact Mass
    390.0678g/mol
    Formal Charge
    0
    Heavy Atom Count
    23
    Monoisotopic Mass
    390.0678g/mol
    Rotatable Bond Count
    0
    XLogP3
    1
    MSDS
    Download MSDS
    COA
    Download COA
    Spec Sheet
    Download Spec Sheet
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