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  • Ruthenium acetylacetonate

  • Ruthenium acetylacetonate

    Catalog Number
    ACM14284936-8
    CAS Number
    14284-93-6
    Product Name
    Ruthenium acetylacetonate
    Structure
    Category
    Salt
    Synonyms
    Rutheniumpentanedionate
    IUPAC Name
    (Z)-4-hydroxypent-3-en-2-one;ruthenium
    Molecular Weight
    401.4
    Molecular Formula
    C15H24O6Ru
    Canonical SMILES
    CC(=CC(=O)C)O.CC(=CC(=O)C)O.CC(=CC(=O)C)O.[Ru]
    InChI
    InChI=1S/3C5H8O2.Ru/c3*1-4(6)3-5(2)7;/h3*3,6H,1-2H3;/b3*4-3-;
    InChI Key
    IYWJIYWFPADQAN-LNTINUHCSA-N
    Melting Point
    260 °C
    Purity
    98%
    Appearance
    Purple crystal
    Application
    Ruthenium acetylacetonate, a compound characterized by its dark-red crystalline structure, serves a pivotal role as a precursor in synthesizing other ruthenium-based compounds. It is primarily utilized as a recyclable catalyst in various organic transformations. This substance is particularly effective in processes such as the acetylation of phenols, alcohols, and amines conducted under neat conditions. It also functions as a homogeneous catalyst in the hydrolysis of sodium borohydride and the regiospecific tritiation of aromatic carboxylic acids. Additionally, ruthenium acetylacetonate is employed in the enantioselective hydrogenation of acids, notably aryl acrylic and aryl propenic acids, highlighting its versatile application in the catalytic domain.
    Complexity
    380
    Covalently-Bonded Unit Count
    4
    Defined Atom Stereocenter Count
    0
    EC Number
    238-193-0
    Exact Mass
    402.061629
    Formal Charge
    0
    Heavy Atom Count
    22
    Hydrogen Bond Acceptor Count
    6
    Hydrogen Bond Donor Count
    3
    Isomeric SMILES
    C/C(=C/C(=O)C)/O.C/C(=C/C(=O)C)/O.C/C(=C/C(=O)C)/O.[Ru]
    Monoisotopic Mass
    402.061629
    Rotatable Bond Count
    3
    Topological Polar Surface Area
    112 Ų
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