CAS 3144-16-9

Chemistry

Chemistry

Also known as: 3144-16-9, ((1s,4r)-7,7-dimethyl-2-oxobicyclo[2.2.1]heptan-1-yl)methanesulfonic acid, Reychler's acid, D-(+)-10-camphorsulfonic acid, (1s)-(+)-10-camphorsulfonic acid, D-(+)-camphor-10-sulfonic acid

Molecular Formula

C₁₀H₁₆O₄S

Molecular Weight

232.30 g/mol

InChI Key

MIOPJNTWMNEORI-GMSGAONNSA-N

FDA UNII

9TLZ01S15L

1 2D Structure

CAS 3144-16-9

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

[(1S,4R)-7,7-dimethyl-2-oxo-1-bicyclo[2.2.1]heptanyl]methanesulfonic acid

2.1.2 InChI

InChI=1S/C10H16O4S/c1-9(2)7-3-4-10(9,8(11)5-7)6-15(12,13)14/h7H,3-6H2,1-2H3,(H,12,13,14)/t7-,10-/m1/s1

2.1.3 InChI Key

MIOPJNTWMNEORI-GMSGAONNSA-N

2.1.4 Canonical SMILES

CC1(C2CCC1(C(=O)C2)CS(=O)(=O)O)C

2.1.5 Isomeric SMILES

CC1([C@@H]2CC[C@]1(C(=O)C2)CS(=O)(=O)O)C

2.2 Other Identifiers

2.2.1 UNII

9TLZ01S15L

2.3 Synonyms

2.3.1 MeSH Synonyms

1. 10-camphorsulfonic Acid

2. 10-camphorsulfonic Acid, (+-)-isomer

3. 10-camphorsulfonic Acid, (1r)-isomer

4. 10-camphorsulfonic Acid, (1s,4r)-(+)-isomer

5. 10-camphorsulfonic Acid, Aluminum Salt

6. 10-camphorsulfonic Acid, Ammonium Salt

7. 10-camphorsulfonic Acid, Bismuth (3+) Salt

8. 10-camphorsulfonic Acid, Calcium Salt

9. 10-camphorsulfonic Acid, Piperazine Salt

10. 10-camphorsulfonic Acid, Sodium Salt

11. Solucampher

2.3.2 Depositor-Supplied Synonyms

1. 3144-16-9

2. ((1s,4r)-7,7-dimethyl-2-oxobicyclo[2.2.1]heptan-1-yl)methanesulfonic Acid

3. Reychler's Acid

4. D-(+)-10-camphorsulfonic Acid

5. (1s)-(+)-10-camphorsulfonic Acid

6. D-(+)-camphor-10-sulfonic Acid

7. Camphor-10-sulfonic Acid

8. Dl-10-camphorsulfonic Acid

9. Camphersulfosaeure

10. (+)-d-camphor-10-sulfonic Acid

11. (s)-camphorsulfonic Acid

12. Camphorsulfonic Acid, D-

13. (r)-camphorsulfonic Acid

14. 9tlz01s15l

15. 2-oxo-10-bornanesulfonic Acid

16. Dl-6-oxobornane-10-sulphonic Acid

17. Mfcd00074827

18. D8d049375q

19. [(1s,4r)-7,7-dimethyl-2-oxobicyclo[2.2.1]heptan-1-yl]methanesulfonic Acid

20. D(+)-10-camphorsulfonic Acid

21. 2-oxobornane-10-sulphonic Acid

22. (+/-)-camphor-10-sulfonic Acid

23. Bicyclo[2.2.1]heptane-1-methanesulfonic Acid, 7,7-dimethyl-2-oxo-, (1s,4r)-

24. Bicyclo(2.2.1)heptane-1-methanesulfonic Acid, 7,7-dimethyl-2-oxo-

25. Mfcd00064157

26. [(1s,4r)-7,7-dimethyl-2-oxo-1-bicyclo[2.2.1]heptanyl]methanesulfonic Acid

27. [(1s,4r)-7,7-dimethyl-2-oxobicyclo[2.2.1]hept-1-yl]methanesulfonic Acid

28. D-camphor Sulfonic Acid

29. 10-camphorsulfonic Acid

30. (+/-)-camphorsulfonic Acid

31. Camphersulfosaeure [german]

32. (+)-csa

33. Unii-9tlz01s15l

34. (1s)-(+)-camphor-10-sulfonic Acid

35. ((1s,4r)-7,7-dimethyl-2-oxobicyclo(2.2.1)hept-1-yl)methanesulfonic Acid

36. Bicyclo(2.2.1)heptane-1-methanesulfonic Acid, 7,7-dimethyl-2-oxo-, (1s,4r)-

37. Einecs 221-554-1

38. Camphor-sulfonic Acid

39. Voriconazole Impurity E

40. Ai3-23953

41. 10-bornanesulfonic Acid, 2-oxo-, (1s,4r)-(+)-

42. Dl-10_camphorsulfonic Acid

43. Schembl60288

44. (1s)-10-camphorsulfonic Acid

45. (?)-camphor-10-sulfonic Acid

46. Unii-d8d049375q

47. Chebi:55403

48. Dtxsid00883956

49. Nsc4167

50. Camphor-10-sulfonic Acid (beta)

51. 10-bornanesulfonic Acid, 2-oxo-

52. (1s,4r)-10-camphorsulfonic Acid

53. Bcp21451

54. D-camphorsulfonic Acid [mi]

55. Nsc-4167

56. Camphorsulfonic Acid, (+)-

57. Einecs 200-949-2

58. Einecs 227-527-0

59. (1s)-(+)-csa

60. Camphorsulfonic Acid [who-dd]

61. ((1s,4r)-7,7-dimethyl-2-oxobicyclo-[2.2.1]heptan-1-yl)methanesulfonic Acid

62. ((1s,4r)-7,7-dimethyl-2-oxobicyclo[2.2.1]heptan-1-yl)methanesulfonicacid

63. (rs)-10-camphorsulfonic Acid

64. Akos005259156

65. Camphorsulfonic Acid, (+/-)-

66. Camphor-10-sulfonic Acid (beta), 98%

67. As-13390

68. D-camphor Sulfonic Acid [usp-rs]

69. (+/-)-camphor-10-sulfonic Acid, 99%

70. (1s)-(+)-10-camphorsulfonic Acid, 99%

71. Voriconazole Impurity E [ep Impurity]

72. (1s,4r)-(+)-2-oxo-10-bornanesulfonic Acid

73. D77358

74. En300-384663

75. A820858

76. J-520206

77. Q27124276

78. (+)-camphor-10-sulfonic Acid, Purum, >=98.0% (t)

79. (+/-)-camphor-10-sulfonic Acid, Purum, >=98.0% (t)

80. (7,7-dimethyl-2-oxobicyclo(2.2.1)hept-1-yl)methanesulphonic Acid

81. Voriconazole Impurity E, European Pharmacopoeia (ep) Reference Standard

82. (1sr,4rs)-7,7-dimethyl-2-oxobicyclo[2.2.1]heptan-1-yl)methanesulfonic Acid

83. D-camphor Sulfonic Acid, United States Pharmacopeia (usp) Reference Standard

84. Rel-((1s,4r)-7,7-dimethyl-2-oxobicyclo[2.2.1]heptan-1-yl)methanesulfonic Acid

85. (+)-(s)-camphor-10-sulfonic Acid; (+)-2-oxo-10-bornanesulfonic Acid; (+)-camphor-10-sulfonic Acid; (+)-camphor--sulfonic Acid

86. [(1s,4r)-7,7-dimethyl-2-oxo-bicyclo[2.2.1]hept-1-yl]methanesulfonic Acid ((+)-10-camphorsulfonic Acid)

87. 2287183-06-4

2.4 Create Date

2005-08-08

3 Chemical and Physical Properties

Molecular Formula	C₁₀H₁₆O₄S
Molecular Weight	232.30 g/mol
XLogP3	0.5
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	2
Exact Mass	g/mol
Monoisotopic Mass	g/mol
Topological Polar Surface Area	79.8
Heavy Atom Count	15
Formal Charge	0
Complexity	404
Isotope Atom Count	0
Defined Atom Stereocenter Count	2
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	1

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