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    Technical details about CAS 251-41-2, learn more about the structure, uses, toxicity, action, side effects and more

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    CAS 251-41-2

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    2D Structure
    1. Also known as: 251-41-2, 1,4-dithiapentalene, Thieno(3,2-b)thiophene, Thienothiophene, Mfcd00179479, Thieno[3,2-b]thiophene, homopolymer
    Molecular Formula
    C6H4S2
    Molecular Weight
    140.2  g/mol
    InChI Key
    VJYJJHQEVLEOFL-UHFFFAOYSA-N
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    thieno[3,2-b]thiophene
    2.1.2 InChI
    InChI=1S/C6H4S2/c1-3-7-6-2-4-8-5(1)6/h1-4H
    2.1.3 InChI Key
    VJYJJHQEVLEOFL-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    C1=CSC2=C1SC=C2
    2.2 Synonyms
    2.2.1 Depositor-Supplied Synonyms

    1. 251-41-2

    2. 1,4-dithiapentalene

    3. Thieno(3,2-b)thiophene

    4. Thienothiophene

    5. Mfcd00179479

    6. Thieno[3,2-b]thiophene, Homopolymer

    7. 94479-77-3

    8. 1,4-thiophthene

    9. Thiophthen

    10. Thieno[3,2-b]-thiophene

    11. Schembl29149

    12. Yswg277

    13. Amot0005

    14. Dtxsid80179783

    15. Thieno[3,2-b]thiophene, 95%

    16. Zinc165492

    17. Act02305

    18. Cs-d1729

    19. Bbl103365

    20. Stl557175

    21. Akos008901312

    22. As-2015

    23. Sb66636

    24. Ac-22785

    25. Sy019859

    26. Db-024762

    27. Am20090288

    28. Ft-0649134

    29. T2513

    30. 251t412

    31. Ai-942/25034154

    32. W-206930

    33. Q27461625

    34. J1z

    2.3 Create Date
    2005-03-27
    3 Chemical and Physical Properties
    Molecular Weight 140.2 g/mol
    Molecular Formula C6H4S2
    XLogP32.7
    Hydrogen Bond Donor Count0
    Hydrogen Bond Acceptor Count2
    Rotatable Bond Count0
    Exact Mass139.97544247 g/mol
    Monoisotopic Mass139.97544247 g/mol
    Topological Polar Surface Area56.5 Ų
    Heavy Atom Count8
    Formal Charge0
    Complexity80.5
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1
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