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  • Chemistry
CAS 937-14-4
Also known as: 937-14-4, 3-chloroperbenzoic acid, M-chloroperbenzoic acid, M-chloroperoxybenzoic acid, 3-chlorobenzenecarboperoxoic acid, Mcpba
Molecular Formula
C7H5ClO3
Molecular Weight
172.56  g/mol
InChI Key
NHQDETIJWKXCTC-UHFFFAOYSA-N
FDA UNII
G203D4H1RB

1 2D Structure

CAS 937-14-4

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
3-chlorobenzenecarboperoxoic acid
2.1.2 InChI
InChI=1S/C7H5ClO3/c8-6-3-1-2-5(4-6)7(9)11-10/h1-4,10H
2.1.3 InChI Key
NHQDETIJWKXCTC-UHFFFAOYSA-N
2.1.4 Canonical SMILES
C1=CC(=CC(=C1)Cl)C(=O)OO
2.2 Other Identifiers
2.2.1 UNII
G203D4H1RB
2.3 Synonyms
2.3.1 MeSH Synonyms

1. 3-chloroperbenzoic Acid

2. M-chloroperbenzoic Acid

3. M-cpba

4. Mcpba

5. Meta-chloroperoxybenzoic Acid

2.3.2 Depositor-Supplied Synonyms

1. 937-14-4

2. 3-chloroperbenzoic Acid

3. M-chloroperbenzoic Acid

4. M-chloroperoxybenzoic Acid

5. 3-chlorobenzenecarboperoxoic Acid

6. Mcpba

7. Benzenecarboperoxoic Acid, 3-chloro-

8. Meta-chloroperoxybenzoic Acid

9. M-chlorobenzoyl Hydroperoxide

10. Meta-chloroperbenzoic Acid

11. 3-chlorobenzoperoxoic Acid

12. M-cpba

13. Perbenzoic Acid, M-chloro-

14. Peroxybenzoic Acid, M-chloro-

15. Nsc 97094

16. 3-chloro-benzenecarboperoxoic Acid

17. Metachloroperbenzoic Acid

18. M-choroperoxybenzoic Acid

19. 3-chlorobenzene-1-carboperoxoic Acid

20. G203d4h1rb

21. Chebi:52091

22. Mfcd00002127

23. Nsc-97094

24. Ccris 639

25. M-chloro-perbenzoic Acid

26. M-chloroperoxybenzoicacid

27. Einecs 213-322-3

28. 3-chloro Peroxybenzoic Acid

29. 3-chloroperoxy-benzoic Acid

30. Brn 0608317

31. Unii-g203d4h1rb

32. M-chloroperbezoic Acid

33. M-chlorperbenzoic Acid

34. 3-chlorperbenzoic Acid

35. Metachlorperbenzoic Acid

36. M-chlor-perbenzoic Acid

37. Meta-chloroperbenzoicacid

38. Metachioroperbenzoic Acid

39. M- Chloroperbenzoic Acid

40. M-chloro Perbenzoic Acid

41. M-chloroper-benzoic Acid

42. 3chloroperoxybenzoic Acid

43. Meta-chlorperbenzoic Acid

44. 3-chloro Perbenzoic Acid

45. 3-chloro-perbenzoic Acid

46. 3-chloroperoxybezoic Acid

47. M-chioroperoxybenzoic Acid

48. Meta Chloroperbenzoic Acid

49. Metachloro Perbenzoic Acid

50. M-chloro-per-benzoic Acid

51. 3-chloro-per-benzoic Acid

52. Metachloroperoxybenzoic Acid

53. 3-chloro Per Benzoic Acid

54. 3-cpba

55. M- Chloroperoxybenzoic Acid

56. M--chloroperoxybenzoic Acid

57. M-chloro Peroxybenzoic Acid

58. M-chloro-peroxybenzoic Acid

59. M-chloroperoxy Benzoic Acid

60. Meta Chloro Perbenzoic Acid

61. Meta-chloro Perbenzoic Acid

62. Meta-chloro-perbenzoic Acid

63. Meta-chloroper-benzoic Acid

64. Ec 213-322-3

65. M-chloroperoxy-benzoic Acid

66. 3 -chloroperoxybenzoic Acid

67. 3-chloro-peroxybenzoic Acid

68. 3-chlorobenzeneperoxoic Acid

69. 3-chlorobenzo-peroxoic Acid

70. 3-chloroper-oxybenzoic Acid

71. 3-chloroperoxy Benzoic Acid

72. Schembl1259

73. Meta Chloroperoxybenzoic Acid

74. M-chloro-peroxy-benzoic Acid

75. Meta-chloro Per Benzoic Acid

76. 3-chloro-peroxy Benzoic Acid

77. 3-chloro-peroxy-benzoic Acid

78. Meta Chloro Peroxybenzoic Acid

79. Meta-chloro Peroxybenzoic Acid

80. Meta-chloro-peroxybenzoic Acid

81. 3-chloroperbenzoic Acid 75%

82. Chembl458855

83. Mcpba, M-chloroperbenzoic Acid

84. Dtxsid0061325

85. M-chlorobenzenecarboperoxoic Acid

86. 3-chloro-benzenecarboperoxic Acid

87. Nhqdetijwkxctc-uhfffaoysa-

88. 3-chloroperbenzoic Acid, <=77%

89. 3-chloroperoxybenzoic Acid, Mcpba

90. 3-chloro-benzene-carboperoxoic Acid

91. 3-chlorobenzenecarboperoxoic Acid #

92. Act00879

93. Bcp27199

94. Nsc97094

95. Stl183297

96. Zinc44361827

97. Akos000121073

98. Un 2755

99. 3-chloroperoxybenzoic Acid [mi]

100. M-chloroperbenzoic Acid; M-cpba; Mcpba

101. Bp-13574

102. Db-002507

103. Bb 0259412

104. Ft-0615501

105. Q284996

106. F0001-2253

107. 3-chloroperbenzoic Acid (technical Grade, 70-75per Cent, Wet With Water)

108. 3-chloroperoxybenzoic Acid, 50-55%, Cont. Ca 10% 3-chlorobenzoic Acid

2.4 Create Date
2005-03-26
3 Chemical and Physical Properties
Molecular Weight 172.56 g/mol
Molecular Formula C7H5ClO3
XLogP32.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Exact Mass171.9927217 g/mol
Monoisotopic Mass171.9927217 g/mol
Topological Polar Surface Area46.5 Ų
Heavy Atom Count11
Formal Charge0
Complexity149
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

Indicators and Reagents

Substances used for the detection, identification, analysis, etc. of chemical, biological, or pathologic processes or conditions. Indicators are substances that change in physical appearance, e.g., color, at or approaching the endpoint of a chemical titration, e.g., on the passage between acidity and alkalinity. Reagents are substances used for the detection or determination of another substance by chemical or microscopical means, especially analysis. Types of reagents are precipitants, solvents, oxidizers, reducers, fluxes, and colorimetric reagents. (From Grant and Hackh's Chemical Dictionary, 5th ed, p301, p499) (See all compounds classified as Indicators and Reagents.)


Oxidants

Electron-accepting molecules in chemical reactions in which electrons are transferred from one molecule to another (OXIDATION-REDUCTION). (See all compounds classified as Oxidants.)


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