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  • 2,2'-Diamino-4,4'-bithiazole

  • 2,2'-Diamino-4,4'-bithiazole

    Catalog Number
    ACM58139596-2
    CAS Number
    58139-59-6
    Product Name
    2,2'-Diamino-4,4'-bithiazole
    Structure
    Category
    Metal Organic Frameworks (MOFs); Monomers
    Synonyms
    4,4'-Bi(thiazole-2-amine); 4,4'-Bi[2-aminothiazole]
    IUPAC Name
    4-(2-amino-1,3-thiazol-4-yl)-1,3-thiazol-2-amine
    Molecular Weight
    198.27
    Molecular Formula
    C6H6N4S2
    Canonical SMILES
    C1=C(N=C(S1)N)C2=CSC(=N2)N
    InChI
    MRFMTBTUKQIBDI-UHFFFAOYSA-N
    InChI Key
    InChI=1S/C6H6N4S2/c7-5-9-3(1-11-5)4-2-12-6(8)10-4/h1-2H,(H2,7,9)(H2,8,10)
    Boiling Point
    499.8±20.0 °C(Predicted)
    Melting Point
    237-240 °C (decomp)
    Purity
    >98.0%(T)(HPLC)
    Density
    1.590±0.06 g/cm3(Predicted)
    Appearance
    White to Almost white powder to crystal
    Storage
    Store under inert gas
    Complexity
    150
    Covalently-Bonded Unit Count
    1
    Exact Mass
    198.00338856
    Hazard Statements
    H315 : Causes skin irritation.H319 : Causes serious eye irritation.
    Heavy Atom Count
    12
    Hydrogen Bond Acceptor Count
    6
    Hydrogen Bond Donor Count
    2
    MDL Number
    MFCD01740587
    Monoisotopic Mass
    198.00338856
    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.
    Refractive Index
    1.62
    Rotatable Bond Count
    1
    Signal Word
    Warning
    Specific Gravity
    1.16
    Topological Polar Surface Area
    134 Ų
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