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ACTIVE PHARMA INGREDIENTS

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Also known as: 137-00-8, Sulfurol, 5-(2-hydroxyethyl)-4-methylthiazole, Hemineurine, 2-(4-methylthiazol-5-yl)ethanol, 2-(4-methyl-1,3-thiazol-5-yl)ethanol

Molecular Formula

C₆H₉NOS

Molecular Weight

143.21 g/mol

InChI Key

BKAWJIRCKVUVED-UHFFFAOYSA-N

FDA UNII

3XYV4I47I8

5-(2-Hydroxyethyl)-4-methylthiazole is a metabolite found in or produced by Saccharomyces cerevisiae.

1 2D Structure

4-Methyl-5-Thiazoleethanol

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

2-(4-methyl-1,3-thiazol-5-yl)ethanol

2.1.2 InChI

InChI=1S/C6H9NOS/c1-5-6(2-3-8)9-4-7-5/h4,8H,2-3H2,1H3

2.1.3 InChI Key

BKAWJIRCKVUVED-UHFFFAOYSA-N

2.1.4 Canonical SMILES

CC1=C(SC=N1)CCO

2.2 Other Identifiers

2.2.1 UNII

3XYV4I47I8

2.3 Synonyms

2.3.1 MeSH Synonyms

1. 2-(4-methyl-1,3-thiazol-5-yl)ethanol

2. 4-methyl-5-hydroxyethylthiazole

3. 5-(2-hydroxyethyl)-4-methylthiazole

4. Thiamine Thiazole Hydrochloride

5. Thiamine Thiazole Phosphate

2.3.2 Depositor-Supplied Synonyms

1. 137-00-8

2. Sulfurol

3. 5-(2-hydroxyethyl)-4-methylthiazole

4. Hemineurine

5. 2-(4-methylthiazol-5-yl)ethanol

6. 2-(4-methyl-1,3-thiazol-5-yl)ethanol

7. 5-thiazoleethanol, 4-methyl-

8. 4-methyl-5-thiazolethanol

9. 4-methyl-5-(2-hydroxyethyl)thiazole

10. Thiamine Thiozole

11. 4-methyl-5-thiazolylethanol

12. 2-(4-methylthiazole-5-yl)ethanol

13. Thiamine Thiazole

14. 4-methyl-5-hydroxethylthiazole

15. 4-methyl-5-hydroxyethylthiazole

16. Mht (van)

17. 2-(4-methyl-thiazol-5-yl)-ethanol

18. 2-(4-methyl-1,3-thiazol-5-yl)ethan-1-ol

19. 5-(hydroxyethyl)-4-methylthiazole

20. 4-methyl-5-thiazole Ethanol

21. 5-(beta-hydroxyethyl)-4-methylthiazole

22. Fema No. 3204

23. Mht

24. Chebi:17957

25. 2-(4-methyl-5-thiazolyl)ethanol

26. Nsc 23262

27. 4-methyl-5-(2-hydroxyethyl)-thiazole

28. 4-methyl-5-(beta-hydroxyethyl)thiazole

29. 4-methyl-5-(2'-hydroxyethyl)-thiazole

30. 4-methyl-5-(.beta.-hydroxyethyl)thiazole

31. 3xyv4i47i8

32. Chembl1236482

33. 4-methylthiazol-5ylethanol

34. Nsc-23262

35. Nsc-41831

36. Het

37. Thiazole, 5-(2-hydroxyethyl)-4-methyl

38. Tze

39. Unii-3xyv4i47i8

40. Einecs 205-272-6

41. Mfcd00005339

42. Nsc 41831

43. Clomethiazole Impurity C

44. Ai3-23391

45. Bmse000355

46. 4-methyl-5-(beta-hydroxyethyl)-thiazole

47. 4-methylthiazole-5-ethanol

48. Dsstox_cid_24382

49. Dsstox_rid_80186

50. 4-methyl-5-thiazole-ethanol

51. Dsstox_gsid_44382

52. Schembl259480

53. Dtxsid3044382

54. Fema 3204

55. 4-methyl-5-thiazoleethanol, 9ci

56. Zinc160790

57. 4-methyl-5-thiazoleethanol, 98%

58. 2-(4-methylthiazol-5-yl) Ethanol

59. 2-(4-methylthiazol-5-yl)-ethanol

60. Nsc23262

61. Nsc41831

62. Str05522

63. Thiazole, 4-methyl-5-hydroxyethyl-

64. Tox21_302187

65. Bdbm50016817

66. Akos000119411

67. 4-metyl-5-(beta-hydroxyethyl)thiazole

68. 5-(2-hydroxyethyl)-4-methyl-thiazole

69. Ab00407

70. Ac-7852

71. Cs-w016411

72. Db02969

73. Hy-w015695

74. Ps-4466

75. Sulfurol (4-methyl-5-thiazoleethanol)

76. 4-methyl-5-hydroxyethyl Thiazole

77. 4-methyl-5-thiazoleethanol [mi]

78. Ncgc00257545-01

79. Cas-137-00-8

80. 4-methyl-5-thiazoleethanol [fhfi]

81. 4-methyl-5-thiazoleethanol, >=98%, Fg

82. 4-methyl-5-thiazole Ethanol [fcc]

83. Db-003514

84. 2-(4-methyl-1,3-thiazol-5-yl)ethanol #

85. 5-(2-hydroxyethyl)-4-methyl-1,3-thiazole

86. Am20080272

87. Ft-0608672

88. H0527

89. 4-methyl-5-thiazoleethanol, Analytical Standard

90. C04294

91. D77790

92. 5-(2-hydroxyethyl)-4-methylthiazole (sulfurol)

93. 5-(.beta.-hydroxyethyl)-4-methylthiazole

94. Q-100145

95. Q27093940

96. Z1259087043

97. 48114b6f-a59b-4e5b-82b1-38b17d2a0b5a

98. Thiamine Breakdown Product 4-methyl-5-thiazoleethanol- From

99. 2-(4-methyl-1,3-thiazol-5-yl)ethanol, Analog Of Clomethiazole (hydroxy Instead Of Chloro)

100. 4-methyl-5-thiazoleethanol; Sulfurol; 4-methyl-5-(2'-hydroxyethyl)-thiazole; 4-methyl-5-hydroxyethylthiazole; 5-(2-hydroxyethyl)-4-methylthiazole; 4-methyl-5-beta-hydroxyethyl Thiazole

101. 860175-16-2

2.4 Create Date

2004-09-16

3 Chemical and Physical Properties

Molecular Formula	C₆H₉NOS
Molecular Weight	143.21 g/mol
XLogP3	0.8
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	2
Exact Mass	143.04048508 g/mol
Monoisotopic Mass	143.04048508 g/mol
Topological Polar Surface Area	61.4 Å²
Heavy Atom Count	9
Formal Charge	0
Complexity	89.1
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	1

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