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  • 4'-Carboxybenzo-15-crown 5-Ether

    • 4'-Carboxybenzo-15-crown 5-Ether

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    Catalog Number
    ACM56683557-1
    Product Name
    4'-Carboxybenzo-15-crown 5-Ether
    Structure
    CAS
    56683-55-7
    Category
    Macrocycles
    IUPAC Name
    2,5,8,11,14-pentaoxabicyclo[13.4.0]nonadeca-1(15),16,18-triene-17-carboxylic acid
    Molecular Weight
    312.31g/mol
    Molecular Formula
    C15H20O7
    Canonical SMILES
    C1COCCOC2=C(C=C(C=C2)C(=O)O)OCCOCCO1
    InChI
    InChI=1S/C15H20O7/c16-15(17)12-1-2-13-14(11-12)22-10-8-20-6-4-18-3-5-19-7-9-21-13/h1-2,11H,3-10H2,(H,16,17)
    InChI Key
    FBNLTQGIRRAGRY-UHFFFAOYSA-N
    Complexity
    323
    Covalently-Bonded Unit Count
    1
    Exact Mass
    312.120903g/mol
    Formal Charge
    0
    Heavy Atom Count
    22
    Monoisotopic Mass
    312.120903g/mol
    Rotatable Bond Count
    1
    XLogP3
    -0.1
    MSDS
    Download MSDS
    COA
    Download COA
    Spec Sheet
    Download Spec Sheet
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