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  • 4'-Aminobenzo-15-crown 5-Ether

  • 4'-Aminobenzo-15-crown 5-Ether

    Catalog Number
    ACM60835714-1
    Product Name
    4'-Aminobenzo-15-crown 5-Ether
    Structure
    CAS
    60835-71-4
    Category
    Macrocycles
    IUPAC Name
    2,5,8,11,14-pentaoxabicyclo[13.4.0]nonadeca-1(15),16,18-trien-17-amine
    Molecular Weight
    283.32g/mol
    Molecular Formula
    C14H21NO5
    Canonical SMILES
    C1COCCOC2=C(C=C(C=C2)N)OCCOCCO1
    InChI
    InChI=1S/C14H21NO5/c15-12-1-2-13-14(11-12)20-10-8-18-6-4-16-3-5-17-7-9-19-13/h1-2,11H,3-10,15H2
    InChI Key
    CQNGAZMLFIMLQN-UHFFFAOYSA-N
    Complexity
    254
    Covalently-Bonded Unit Count
    1
    Exact Mass
    283.141973g/mol
    Formal Charge
    0
    Heavy Atom Count
    20
    MeSH Entry Terms
    4'-aminobenzo-15-crown-5
    Monoisotopic Mass
    283.141973g/mol
    Rotatable Bond Count
    0
    XLogP3
    -0.3
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