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    Technical details about CAS-333-27-7, learn more about the structure, uses, toxicity, action, side effects and more

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    CAS-333-27-7

    Manufacturers/Suppliers

    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: 333-27-7, Methyl triflate, Methyl trifluoromethanesulphonate, Methanesulfonic acid, trifluoro-, methyl ester, Methyl trifluoromethane sulfonate, Trifluoromethanesulfonic acid methyl ester
    Molecular Formula
    C2H3F3O3S
    Molecular Weight
    164.11  g/mol
    InChI Key
    OIRDBPQYVWXNSJ-UHFFFAOYSA-N
    FDA UNII
    7B25Z22EPV
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    methyl trifluoromethanesulfonate
    2.1.2 InChI
    InChI=1S/C2H3F3O3S/c1-8-9(6,7)2(3,4)5/h1H3
    2.1.3 InChI Key
    OIRDBPQYVWXNSJ-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    COS(=O)(=O)C(F)(F)F
    2.2 Other Identifiers
    2.2.1 UNII
    7B25Z22EPV
    2.3 Synonyms
    2.3.1 MeSH Synonyms

    1. Methyl Triflate

    2. Triflic Acid Methyl Ester

    3. Trifluoromethanesulfonic Acid Methyl Ester

    2.3.2 Depositor-Supplied Synonyms

    1. 333-27-7

    2. Methyl Triflate

    3. Methyl Trifluoromethanesulphonate

    4. Methanesulfonic Acid, Trifluoro-, Methyl Ester

    5. Methyl Trifluoromethane Sulfonate

    6. Trifluoromethanesulfonic Acid Methyl Ester

    7. Meotf

    8. 7b25z22epv

    9. Nsc-270679

    10. Trifluoro-methanesulfonic Acid Methyl Ester

    11. Methanesulfonic Acid, 1,1,1-trifluoro-, Methyl Ester

    12. Trifluoromethanesulfonicacidmethylester

    13. Ccris 1158

    14. Einecs 206-371-7

    15. Methyltrifluoromethanesulfonate

    16. Nsc 270679

    17. Methyltriflate

    18. Unii-7b25z22epv

    19. Methyl Trifiate

    20. Ai3-62911

    21. Tfome

    22. Cf3so2och3

    23. Dsstox_cid_29128

    24. Dsstox_rid_83347

    25. 1,1,1-trifluoromethanesulfonic Acid Methyl Ester

    26. Dsstox_gsid_49272

    27. Schembl38490

    28. Methyl Trifloromethanesulfonate

    29. Methyl Trifluoromethylsulfonate

    30. Methyltrifluoromethane Sulfonate

    31. Methyl Trifluoromethane-sulfonate

    32. Chembl3185488

    33. Dtxsid6049272

    34. Amy8849

    35. Bcp22549

    36. Cs-b0882

    37. Tox21_202914

    38. Fd2053

    39. Mfcd00000409

    40. Nsc270679

    41. Zinc59699224

    42. Methyl Tris(fluoranyl)methanesulfonate

    43. Akos005063680

    44. Gc10216

    45. Trifluoro-methansulfonic Acid Methylester

    46. Trifluoromethylsulfonic Acid Methyl Ester

    47. Methyl Trifluoromethanesulfonate, >=98%

    48. Ncgc00260460-01

    49. As-18305

    50. Bp-21280

    51. Cas-333-27-7

    52. Db-030038

    53. Ft-0628818

    54. Methyl Trifluoromethanesulfonate [mi]

    55. T2029

    56. A821727

    57. Q907614

    58. J-019144

    59. J-522641

    60. F1905-7179

    61. Methyl Trifluoromethanesulfonate, For Gc Derivatization, 98.0%

    62. Methyl Triflate;methyl Trifluoromethanesulfonate;methyl Trifluoromethanesulphonate;trifluoromethanesulfonic Acid Methyl Ester

    2.4 Create Date
    2005-03-26
    3 Chemical and Physical Properties
    Molecular Weight 164.11 g/mol
    Molecular Formula C2H3F3O3S
    XLogP30.9
    Hydrogen Bond Donor Count0
    Hydrogen Bond Acceptor Count6
    Rotatable Bond Count1
    Exact Mass g/mol
    Monoisotopic Mass g/mol
    Topological Polar Surface Area51.8
    Heavy Atom Count9
    Formal Charge0
    Complexity172
    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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