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  • Tris(2-carboxyethyl) Isocyanurate

    Catalog Number
    ACM2904418-1
    CAS Number
    2904-41-8
    Product Name
    Tris(2-carboxyethyl) Isocyanurate
    Structure
    Category
    Monomers
    IUPAC Name
    3-[3,5-bis(2-carboxyethyl)-2,4,6-trioxo-1,3,5-triazinan-1-yl]propanoic acid
    Molecular Weight
    345.26g/mol
    Molecular Formula
    C12H15N3O9
    Canonical SMILES
    C(CN1C(=O)N(C(=O)N(C1=O)CCC(=O)O)CCC(=O)O)C(=O)O
    InChI
    InChI=1S/C12H15N3O9/c16-7(17)1-4-13-10(22)14(5-2-8(18)19)12(24)15(11(13)23)6-3-9(20)21/h1-6H2,(H,16,17)(H,18,19)(H,20,21)
    InChI Key
    HENCHDCLZDQGIQ-UHFFFAOYSA-N
    Complexity
    484
    Covalently-Bonded Unit Count
    1
    EC Number
    220-803-1
    Exact Mass
    345.080829g/mol
    Formal Charge
    0
    Heavy Atom Count
    24
    Monoisotopic Mass
    345.080829g/mol
    NSC Number
    11694
    Rotatable Bond Count
    9
    XLogP3
    -2.1
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