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  • 1,4,7,10,13,16-Hexaazacyclooctadecane Hexahydrochloride

  • 1,4,7,10,13,16-Hexaazacyclooctadecane Hexahydrochloride

    Catalog Number
    ACM58105912
    Product Name
    1,4,7,10,13,16-Hexaazacyclooctadecane Hexahydrochloride
    Structure
    CAS
    58105-91-2
    Category
    Macrocycles
    Synonyms
    1,4,7,10,13,16-Hexaazacyclooctadecane Hexa hydrochloride; DTXSID70507632; ANW-32876; TR-020225; Hexacyclen Hexahydrochloride; I14-91566; CTK8B1954;
    IUPAC Name
    1,4,7,10,13,16-hexazacyclooctadecane;hexahydrochloride;
    Molecular Weight
    477.162g/mol
    Molecular Formula
    C12H36Cl6N6;
    Canonical SMILES
    C1CNCCNCCNCCNCCNCCN1.Cl.Cl.Cl.Cl.Cl.Cl;
    InChI
    InChI=1S/C12H30N6.6ClH/c1-2-14-5-6-16-9-10-18-12-11-17-8-7-15-4-3-13-1;;;;;;/h13-18H,1-12H2;6*1H;
    InChI Key
    GYXOJYBVPYIMAW-UHFFFAOYSA-N;
    Complexity
    108
    Covalently-Bonded Unit Count
    7
    Exact Mass
    476.11g/mol
    Heavy Atom Count
    24
    Monoisotopic Mass
    474.113g/mol
    Topological Polar Surface Area
    72.2A^2
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