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    CAS 7677-24-9

    BUILDING BLOCK

    PharmaCompass
    Xls

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    2D Structure
    Also known as: 7677-24-9, Trimethylsilanecarbonitrile, Cyanotrimethylsilane, Trimethylsilylcyanide, Trimethylsilylformonitrile, Silanecarbonitrile, trimethyl-
    Molecular Formula
    C4H9NSi
    Molecular Weight
    99.21  g/mol
    InChI Key
    LEIMLDGFXIOXMT-UHFFFAOYSA-N
    Trimethylsilyl cyanide is a chemical compound of cyanide. It is used in organic synthesis. (L106)
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    trimethylsilylformonitrile
    2.1.2 InChI
    InChI=1S/C4H9NSi/c1-6(2,3)4-5/h1-3H3
    2.1.3 InChI Key
    LEIMLDGFXIOXMT-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    C[Si](C)(C)C#N
    2.2 Synonyms
    2.2.1 MeSH Synonyms

    1. Tmscn

    2.2.2 Depositor-Supplied Synonyms

    1. 7677-24-9

    2. Trimethylsilanecarbonitrile

    3. Cyanotrimethylsilane

    4. Trimethylsilylcyanide

    5. Trimethylsilylformonitrile

    6. Silanecarbonitrile, Trimethyl-

    7. Trimethylsilylnitrile

    8. Trimethylsilane Carbonitrile

    9. Trimethylsilylcarbonitrile

    10. Mfcd00001765

    11. Tms Cyanide

    12. Tmscn

    13. Trimethyl Silyl Cyanide

    14. Trimethyl Silane Cyanide

    15. Tms-cyanide

    16. Cyanotrimethlysilane

    17. Trimethylcyanosilane

    18. Trimethylsilylcyanid

    19. Trimethysilylcyanide

    20. Cyanotrimethyl Silane

    21. Cyanotrimethyl-silane

    22. Einecs 231-657-3

    23. Trimethysilyl Cyanide

    24. Me3sicn

    25. Trimethylsilanecyanide

    26. Tri-methylsilylcyanide

    27. Trimethyl Silylcyanide

    28. Trimethylsilyl-cyanide

    29. Trimethyl Cyano Silane

    30. Tri-methylsilyl Cyanide

    31. Trimethyl-silyl Cyanide

    32. (trimethylsilyl)cyanide

    33. Trimethyl Silyl Nitrile

    34. Tms-cn

    35. Trimethylsilyl-formonitrile

    36. Trimethylsilylcyanide,99%

    37. Trimethylsilylmethanenitrile

    38. (ch3)3sicn

    39. (trimethylsilyl)formonitrile

    40. Trimethylsilanecarbonitrile #

    41. Trimethylsilyl Cyanide, 98%

    42. Trimethylsilyl Cyanide, 97%

    43. Dtxsid9064766

    44. Amy6985

    45. Act02612

    46. Albb-018705

    47. Bcp25853

    48. Trimethylsilyl Cyanide-[13c,15n]

    49. Bbl036271

    50. Stl558690

    51. Akos000121901

    52. Zinc169743077

    53. Pb23143

    54. Bp-11377

    55. Ls-06137

    56. Db-030488

    57. Cs-0015833

    58. Ft-0647485

    59. T0990

    60. En300-29571

    61. S19150

    62. Trimethylsilyl Cyanide, Technical, >=95% (gc)

    63. A838824

    64. Q3008073

    65. F0001-1959

    2.3 Create Date
    2005-03-27
    3 Chemical and Physical Properties
    Molecular Weight 99.21 g/mol
    Molecular Formula C4H9NSi
    Hydrogen Bond Donor Count0
    Hydrogen Bond Acceptor Count1
    Rotatable Bond Count0
    Exact Mass g/mol
    Monoisotopic Mass g/mol
    Topological Polar Surface Area23.8
    Heavy Atom Count6
    Formal Charge0
    Complexity81.5
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1
    4 Drug and Medication Information
    4.1 Minimum/Potential Fatal Human Dose

    200 to 300 milligrams for an adult human (cyanide salts). (T86)

    5 Pharmacology and Biochemistry
    5.1 Metabolism/Metabolites

    Organic nitriles are converted into cyanide ions through the action of cytochrome P450 enzymes in the liver. Cyanide is rapidly absorbed and distributed throughout the body. Cyanide is mainly metabolized into thiocyanate by either rhodanese or 3-mercaptopyruvate sulfur transferase. Cyanide metabolites are excreted in the urine. (L96)