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2D Structure
Also known as: 1774-47-6, Trimethylsulphoxonium iodide, Trimethyloxosulfonium iodide, Trimethyloxosulphonium iodide, Sulfoxonium, trimethyl-, iodide, Mfcd00011899
Molecular Formula
C3H9IOS
Molecular Weight
220.07  g/mol
InChI Key
BPLKQGGAXWRFOE-UHFFFAOYSA-M

1 2D Structure

2D Structure

2 Identification
2.1 Computed Descriptors
2.1.1 InChI
InChI=1S/C3H9OS.HI/c1-5(2,3)4;/h1-3H3;1H/q+1;/p-1
2.1.2 InChI Key
BPLKQGGAXWRFOE-UHFFFAOYSA-M
2.1.3 Canonical SMILES
C[S+](=O)(C)C.[I-]
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. 1774-47-6

2. Trimethylsulphoxonium Iodide

3. Trimethyloxosulfonium Iodide

4. Trimethyloxosulphonium Iodide

5. Sulfoxonium, Trimethyl-, Iodide

6. Mfcd00011899

7. Sulfoxonium, Trimethyl-, Iodide (1:1)

8. Trimethylsulfoxoniumiodide

9. Trimethyl Sulphoxonium Ioidie

10. S,s,s-trimethylsulfoxonium Iodide

11. Einecs 217-204-2

12. Nsc 71213

13. Sulfonium, Trimethyl-, Iodide, Oxide

14. Sulfoxonium, Iodide

15. Trimethysulfoxonium Iodide

16. Sulfonium, Iodide, Oxide

17. Trimehylsulphoxonium Iodide

18. Ec 217-204-2

19. Tri-methylsulfoxonium Iodide

20. Trimethyl Sulfoxonium Iodide

21. Trimethyl-sulfoxonium Iodide

22. Schembl2584

23. Schembl2586

24. Trimethyl Sulphoxonium Iodide

25. Trimethyl-oxosulfonium Iodide

26. Trimethyloxo Sulfonium Iodide

27. Trimethyl-sulphoxonium Iodide

28. Trimethyl Oxosulphonium Iodide

29. Tri-methyl-oxosulphonium Iodide

30. Trimethyl-sulfoniumoxide Iodide

31. S,s-trimethylsulfoxonium Iodide

32. Trimethyl(oxo)-sulfanylium Iodide

33. Dtxsid001014581

34. Act04864

35. Amy24038

36. Bcp13230

37. Nsc71213

38. Trimethyl?sulfoxonium?iodide(tmsoi)

39. Ac7850

40. Nsc-71213

41. Trimethyl(oxo)-??-sulfanylium Iodide

42. Wln: Os1&1&1 &q &i

43. Akos015833276

44. Cs-w018549

45. Trimethyl(oxo)-gamma-sulfanylium Iodide

46. As-12135

47. Sy002188

48. Db-044297

49. Ft-0633832

50. T1065

51. J-200120

52. J-650228

53. Q15427957

54. F0001-0645

2.2.2 Other Synonyms

1. Cas 1774-47-6

2.3 Create Date
2005-08-08
3 Chemical and Physical Properties
Molecular Weight 220.07 g/mol
Molecular Formula C3H9IOS
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Exact Mass g/mol
Monoisotopic Mass g/mol
Topological Polar Surface Area18.1
Heavy Atom Count6
Formal Charge0
Complexity53
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count2