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  • 2,5-Thiophenedicarboxylic acid

  • 2,5-Thiophenedicarboxylic acid

    Catalog Number
    ACM4282319
    CAS Number
    4282-31-9
    Product Name
    2,5-Thiophenedicarboxylic acid
    Structure
    Category
    Electroluminescence Materials; Polymers
    Synonyms
    TH-2COOH
    IUPAC Name
    thiophene-2,5-dicarboxylic acid
    Molecular Weight
    172.15
    Molecular Formula
    C6H4O4S
    Canonical SMILES
    C1=C(SC(=C1)C(=O)O)C(=O)O
    InChI
    InChI=1S/C6H4O4S/c7-5(8)3-1-2-4(11-3)6(9)10/h1-2H,(H,7,8)(H,9,10)
    InChI Key
    YCGAZNXXGKTASZ-UHFFFAOYSA-N
    Boiling Point
    >300 °C-lit.
    Melting Point
    >300 °C-lit.
    Purity
    98%
    Appearance
    Solid
    Application
    2,5-Thiophenedicarboxylic acid is a versatile compound primarily used as a thiophene-based linker in the production of magnesium coordination networks. It serves as a crucial precursor in the synthesis of 2,5-bis-benzoxazoyl-thiophene (EBF) and is employed in creating innovative materials including new cobalt(II) thiophenedicarboxylate coordination polymers. This compound also plays a vital role in the development of novel mesogenic thiophene-based supramolecular liquid crystals. Additionally, it is instrumental in synthesizing unique coordination polymers like {[Ln2(2,5-tdc)3(dmso)2]H2O}n, where Ln represents Tb(III) and Dy(III), illustrating its broad application in advanced material science.
    Storage
    Store under inert gas
    Complexity
    171
    Covalently-Bonded Unit Count
    1
    EC Number
    224-284-2
    Exact Mass
    171.98303g/mol
    Formal Charge
    0
    Hazard Statements
    H315 : Causes skin irritation.H319 : Causes serious eye irritation.
    Heavy Atom Count
    11
    MDL Number
    MFCD00016896
    Monoisotopic Mass
    171.98303g/mol
    NSC Number
    81789
    Precautionary Statements
    P264 : Wash skin thoroughly after handling.P280 : Wear protective gloves/ eye protection/ face protection.P337 + P313 : If eye irritation persists: Get medical advice/ attention.P305 + P351 + P338 : IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing.P302 + P352 : IF ON SKIN: Wash with plenty of soap and water.P332 + P313 : If skin irritation occurs: Get medical advice/ attention.P362 : Take off contaminated clothing and wash before reuse.
    Rotatable Bond Count
    2
    Signal Word
    Warning
    UNII
    5Q8A2G9Y8A
    XLogP3
    1.3
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