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    Technical details about CAS 39098-97-0, learn more about the structure, uses, toxicity, action, side effects and more

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    CAS 39098-97-0

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    PharmaCompass

    Biophore is a research-driven global pharmaceutical company focused on niche APIs for the generic industry.

    Athena Pharmaceutiques is a Partner of Choice for Drug Delivery & Life Cycle Management.

    2D Structure
    1. Also known as: 39098-97-0, 2-(thiophen-2-yl)acetyl chloride, 2-thienylacetyl chloride, 2-thiophene acetyl chloride, Thiophene-2-acetyl chloride, 2-(2-thienyl)acetyl chloride
    Molecular Formula
    C6H5ClOS
    Molecular Weight
    160.62  g/mol
    InChI Key
    AJYXPNIENRLELY-UHFFFAOYSA-N
    FDA UNII
    3VR2Y6J8UG
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    2-thiophen-2-ylacetyl chloride
    2.1.2 InChI
    InChI=1S/C6H5ClOS/c7-6(8)4-5-2-1-3-9-5/h1-3H,4H2
    2.1.3 InChI Key
    AJYXPNIENRLELY-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    C1=CSC(=C1)CC(=O)Cl
    2.2 Other Identifiers
    2.2.1 UNII
    3VR2Y6J8UG
    2.3 Synonyms
    2.3.1 Depositor-Supplied Synonyms

    1. 39098-97-0

    2. 2-(thiophen-2-yl)acetyl Chloride

    3. 2-thienylacetyl Chloride

    4. 2-thiophene Acetyl Chloride

    5. Thiophene-2-acetyl Chloride

    6. 2-(2-thienyl)acetyl Chloride

    7. 2-thiophen-2-ylacetyl Chloride

    8. Thiopheneacetyl Chloride

    9. 2-thiopheneacetylchloride

    10. Thienylacetyl Chloride

    11. Thien-2-ylacetyl Chloride

    12. 3vr2y6j8ug

    13. Thiophen-2-yl-acetyl Chloride

    14. Mfcd00005456

    15. Thiophen-2-ylacetyl Chloride

    16. Thienylacetylchloride

    17. Einecs 254-290-0

    18. Thienyl Acetyl Chloride

    19. Thiophene Acetyl Chloride

    20. 2-thiophenacetyl Chloride

    21. Thiophene-2-acetylchlorid

    22. 2-thienyl Acetyl Chloride

    23. Thiophene-2-acetylchloride

    24. 2-thiophenylacetyl Chloride

    25. Unii-3vr2y6j8ug

    26. (2-thienyl)acetyl Chloride

    27. Thien-2-yl-acetyl Chloride

    28. (thien-2-yl)acetyl Chlorid

    29. Schembl42105

    30. 2-thienylacetic Acid Chloride

    31. (thien-2-yl)-acetyl Chloride

    32. 2-thienyl Acetic Acid Chloride

    33. 2-(2-thienyl)ethanoyl Chloride

    34. Dtxsid5068156

    35. 2-thiopheneacetyl Chloride, 98%

    36. Bcp30941

    37. Zinc2141010

    38. 2-(2-thienyl)-acetic Acid Chloride

    39. Bbl027527

    40. Stk802615

    41. Akos000268646

    42. 2-(thiophen-2-yl)acetic Acid Chloride

    43. Cs-w016145

    44. Gs-6669

    45. Bp-21429

    46. Db-049373

    47. Am20100031

    48. Ft-0639525

    49. T1751

    50. D78176

    51. 2-heptyl-1,3-dioxalaneoctanalglycolacetal

    52. A824405

    53. Sr-01000944734

    54. 2-thienylacetyl Chloride;thiophene-2-acetyl Chloride

    55. Q-100454

    56. Sr-01000944734-1

    57. 2-(2-thienyl)acetyl Chloride;2-thiopheneacetyl Chloride

    58. F2190-0117

    2.4 Create Date
    2005-07-19
    3 Chemical and Physical Properties
    Molecular Weight 160.62 g/mol
    Molecular Formula C6H5ClOS
    XLogP32
    Hydrogen Bond Donor Count0
    Hydrogen Bond Acceptor Count2
    Rotatable Bond Count2
    Exact Mass159.9749636 g/mol
    Monoisotopic Mass159.9749636 g/mol
    Topological Polar Surface Area45.3 Ų
    Heavy Atom Count9
    Formal Charge0
    Complexity116
    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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