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    Technical details about CAS 609-40-5, learn more about the structure, uses, toxicity, action, side effects and more

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    CAS 609-40-5

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    PharmaCompass

    Farmhispania Group, a leading European CDMO in HPAPI Technologies & High Potency Fermentation.

    One Pharma aims to be one of the leading generic companies in Europe.

    2D Structure
    1. Also known as: 609-40-5, Thiophene, 2-nitro-, 2-nitro-thiophene, 2-nitro thiophene, Mfcd00005425, 2-nitrothiophene, tech., 85%
    Molecular Formula
    C4H3NO2S
    Molecular Weight
    129.14  g/mol
    InChI Key
    JIZRGGUCOQKGQD-UHFFFAOYSA-N
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    2-nitrothiophene
    2.1.2 InChI
    InChI=1S/C4H3NO2S/c6-5(7)4-2-1-3-8-4/h1-3H
    2.1.3 InChI Key
    JIZRGGUCOQKGQD-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    C1=CSC(=C1)[N+](=O)[O-]
    2.2 Synonyms
    2.2.1 Depositor-Supplied Synonyms

    1. 609-40-5

    2. Thiophene, 2-nitro-

    3. 2-nitro-thiophene

    4. 2-nitro Thiophene

    5. Mfcd00005425

    6. 2-nitrothiophene, Tech., 85%

    7. Nsc 5371

    8. Einecs 210-190-9

    9. Nitrothiophene

    10. Ai3-16618

    11. 2-nitrothiofene

    12. Nsc5371

    13. 2-nitrothiophene, Tech.

    14. Wln: T5sj Bnw

    15. Bidd:gt0164

    16. Schembl136001

    17. Dtxsid9060570

    18. Jizrggucoqkgqd-uhfffaoysa-

    19. Nsc-5371

    20. Zinc1680876

    21. Stl282559

    22. Akos000268995

    23. Ac-4912

    24. Cs-w016550

    25. Gs-6133

    26. 2-nitrothiophene, 85%, Technical Grade

    27. Db-053752

    28. Am20100484

    29. Ft-0613223

    30. Ft-0695552

    31. N0407

    32. F13472

    33. W-105221

    34. Q27452741

    2.3 Create Date
    2005-03-26
    3 Chemical and Physical Properties
    Molecular Weight 129.14 g/mol
    Molecular Formula C4H3NO2S
    XLogP31.6
    Hydrogen Bond Donor Count0
    Hydrogen Bond Acceptor Count3
    Rotatable Bond Count0
    Exact Mass128.98844951 g/mol
    Monoisotopic Mass128.98844951 g/mol
    Topological Polar Surface Area74.1 Ų
    Heavy Atom Count8
    Formal Charge0
    Complexity101
    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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