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  • Pentanoic acid,4-cyano-4-[[(dodecylthio)thioxomethyl]thio]-

  • Pentanoic acid,4-cyano-4-[[(dodecylthio)thioxomethyl]thio]-

    Catalog Number
    ACM870196808
    CAS Number
    870196-80-8
    Product Name
    Pentanoic acid,4-cyano-4-[[(dodecylthio)thioxomethyl]thio]-
    Structure
    Category
    Polymerization Reagents
    IUPAC Name
    4-cyano-4-dodecylsulfanylcarbothioylsulfanylpentanoic acid
    Molecular Weight
    403.7g/mol
    Molecular Formula
    C19H33NO2S3
    Canonical SMILES
    CCCCCCCCCCCCSC(=S)SC(C)(CCC(=O)O)C#N
    InChI
    InChI=1S/C19H33NO2S3/c1-3-4-5-6-7-8-9-10-11-12-15-24-18(23)25-19(2,16-20)14-13-17(21)22/h3-15H2,1-2H3,(H,21,22)
    InChI Key
    RNTXYZIABJIFKQ-UHFFFAOYSA-N
    Complexity
    434
    Covalently-Bonded Unit Count
    1
    Exact Mass
    403.167343g/mol
    Formal Charge
    0
    Heavy Atom Count
    25
    MeSH Entry Terms
    4-cyano-4-((dodecylsulfanylthiocarbonyl)sulfanyl)pentanoic acid
    Monoisotopic Mass
    403.167343g/mol
    Rotatable Bond Count
    17
    XLogP3
    7.6
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