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  • Diethyl bis(hydroxymethyl)malonate, 97%

  • Diethyl bis(hydroxymethyl)malonate, 97%

    Catalog Number
    ACM20605010-1
    CAS Number
    20605-01-0
    Product Name
    Diethyl bis(hydroxymethyl)malonate, 97%
    Structure
    Category
    Monomers
    IUPAC Name
    diethyl 2,2-bis(hydroxymethyl)propanedioate
    Molecular Weight
    220.22g/mol
    Molecular Formula
    C9H16O6
    Canonical SMILES
    CCOC(=O)C(CO)(CO)C(=O)OCC
    InChI
    InChI=1S/C9H16O6/c1-3-14-7(12)9(5-10,6-11)8(13)15-4-2/h10-11H,3-6H2,1-2H3
    InChI Key
    WIOHBOKEUIHYIC-UHFFFAOYSA-N
    Application
    Diethyl bis(hydroxymethyl)malonate, 97%, is a white to almost white crystalline solid primarily utilized as a reagent in the synthesis of 1,3-dioxanes from acetals, aldehydes, and ketones. Additionally, it serves as an essential intermediate in the production of various substituted malonic, acrylic, and isobutyric esters. This compound is instrumental in creating useful dienophiles, including α-bromomethylacrylic acid and its ethyl ester, as well as bis(bromomethyl)acetic acid and its methyl ester.
    Complexity
    201
    Covalently-Bonded Unit Count
    1
    EC Number
    243-916-8
    Exact Mass
    220.094688g/mol
    Formal Charge
    0
    Heavy Atom Count
    15
    Monoisotopic Mass
    220.094688g/mol
    NSC Number
    218327
    Rotatable Bond Count
    8
    XLogP3
    -0.6
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