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Dimethyl Sulfone
Also known as: Methyl sulfone, 67-71-0, Methylsulfonylmethane, Dimethylsulfone, Dimethyl sulphone, Sulfonylbismethane
Molecular Formula
C2H6O2S
Molecular Weight
94.14  g/mol
InChI Key
HHVIBTZHLRERCL-UHFFFAOYSA-N
FDA UNII
9H4PO4Z4FT

methylsulfonylmethane is a natural product found in Aloe africana, Psidium guajava, and other organisms with data available.
1 2D Structure

Dimethyl Sulfone

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
methylsulfonylmethane
2.1.2 InChI
InChI=1S/C2H6O2S/c1-5(2,3)4/h1-2H3
2.1.3 InChI Key
HHVIBTZHLRERCL-UHFFFAOYSA-N
2.1.4 Canonical SMILES
CS(=O)(=O)C
2.2 Other Identifiers
2.2.1 UNII
9H4PO4Z4FT
2.3 Synonyms
2.3.1 MeSH Synonyms

1. Dimethyl Sulfone, 13c-labeled

2. Methyl Sulfone

3. Methyl Sulfonmethane

4. Methylsulfonylmethane

2.3.2 Depositor-Supplied Synonyms

1. Methyl Sulfone

2. 67-71-0

3. Methylsulfonylmethane

4. Dimethylsulfone

5. Dimethyl Sulphone

6. Sulfonylbismethane

7. Methane, Sulfonylbis-

8. Sulfonyldimethane

9. Sulphonylbismethane

10. Dmso2

11. Methylsulfonyl Methane

12. Methanesulfonylmethane

13. (methylsulfonyl)methane

14. Methyl Sulfonyl Methane

15. Nsc 63345

16. 9h4po4z4ft

17. Chembl25028

18. Methane, 1,1'-sulfonylbis-

19. Chebi:9349

20. Nsc-63345

21. Methylsulfone

22. Ccris 2938

23. Einecs 200-665-9

24. Unii-9h4po4z4ft

25. Dimethylsulfon

26. Dimethylsulphone

27. Methy Sulfone

28. Methyl Sulphone

29. Ai3-25306

30. Lignisul Msm

31. Sulfonylbis-methane

32. Opti Msm

33. Sulfone, Dimethyl-

34. Mfcd00007566

35. (methylsulphonyl)methane

36. Dimethyl Sulfone Solution

37. Dimethyl Sulfone, 98%

38. Methosulfonylmethane

39. 2-thiapropane2,2-dioxide

40. Molmap_000019

41. Dsstox_cid_23937

42. Dsstox_gsid_43937

43. Dimethyl Sulfone [mi]

44. Spectrum1505358

45. Dimethyl Sulfone [inci]

46. Dtxsid4043937

47. Dimethyl Sulfone [mart.]

48. Amy25756

49. Hy-y1314

50. Nsc63345

51. Zinc4658606

52. Methylsulfonylmethane [vandf]

53. Tox21_303712

54. Bdbm50026473

55. Methylsulfonylmethane [usp-rs]

56. Methylsulfonylmethane [who-dd]

57. Akos015897615

58. Ccg-214558

59. Db14090

60. Cas-67-71-0

61. Ncgc00095990-01

62. Ncgc00357027-01

63. Db-050533

64. Mythylsulfonylmethane (msm) [vandf]

65. Cs-0017786

66. Ft-0625160

67. M0509

68. M1239

69. En300-79559

70. D70240

71. A835859

72. Q423842

73. Dimethyl Sulfoxide Impurity A [ep Impurity]

74. F0001-1776

75. Z417007936

76. Dimethyl Sulfone, Standard For Quantitative Nmr, Tracecert(r)

77. Methylsulfonylmethane, United States Pharmacopeia (usp) Reference Standard

78. Methylsulfonylmethane, Pharmaceutical Secondary Standard; Certified Reference Material

2.4 Create Date
2004-09-16
3 Chemical and Physical Properties
Molecular Weight 94.14 g/mol
Molecular Formula C2H6O2S
XLogP3-0.4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Exact Mass94.00885060 g/mol
Monoisotopic Mass94.00885060 g/mol
Topological Polar Surface Area42.5 Ų
Heavy Atom Count5
Formal Charge0
Complexity85.3
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1
4 Pharmacology and Biochemistry
4.1 MeSH Pharmacological Classification

Anti-Inflammatory Agents

Substances that reduce or suppress INFLAMMATION. (See all compounds classified as Anti-Inflammatory Agents.)


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