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  • Dipentamethylenethiuram tetrasulfide

  • Dipentamethylenethiuram tetrasulfide

    Catalog Number
    ACM120547-2
    Product Name
    Dipentamethylenethiuram tetrasulfide
    Structure
    CAS
    120-54-7
    Category
    Plastic Additives
    Synonyms
    Bis(pentamethylene)thiuram tetrasulfide
    Description
    OtherSolid
    IUPAC Name
    (Piperidine-1-carbothioyltrisulfanyl) piperidine-1-carbodithioate
    Molecular Weight
    384.7
    Molecular Formula
    C12H20N2S6
    Canonical SMILES
    C1CCN(CC1)C(=S)SSSSC(=S)N2CCCCC2
    InChI
    InChI=1S/C12H20N2S6/c15-11(13-7-3-1-4-8-13)17-19-20-18-12(16)14-9-5-2-6-10-14/h1-10H2
    InChI Key
    VNDRMZTXEFFQDR-UHFFFAOYSA-N
    Boiling Point
    510.1±33.0 °C
    Melting Point
    118.0-122.0 °C
    Purity
    98%
    Density
    1.4933 g/cm3
    Complexity
    294
    Covalently-Bonded Unit Count
    1
    Defined Atom Stereocenter Count
    0
    Defined Bond Stereocenter Count
    0
    EC Number
    204-406-0
    Exact Mass
    383.99507569
    Formal Charge
    0
    Heavy Atom Count
    20
    Hydrogen Bond Acceptor Count
    6
    Hydrogen Bond Donor Count
    0
    Isotope Atom Count
    0
    Log P
    2.8 (LogP)
    Monoisotopic Mass
    383.99507569
    NSC Number
    4823
    Rotatable Bond Count
    5
    RTECS Number
    TN4221000
    Topological Polar Surface Area
    172 Ų
    Undefined Atom Stereocenter Count
    0
    Undefined Bond Stereocenter Count
    0
    UNII
    YX3WH7S23F
    XLogP3
    4.3
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