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CAS 140-75-0
PharmaCompass
CAS 140-75-0
Also known as: 140-75-0, (4-fluorophenyl)methanamine, Benzenemethanamine, 4-fluoro-, P-fluorobenzylamine, Benzylamine, p-fluoro-, P-fluorobenzyl amine
Molecular Formula
C7H8FN
Molecular Weight
125.146  g/mol
InChI Key
IIFVWLUQBAIPMJ-UHFFFAOYSA-N

1 2D Structure

CAS 140-75-0

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
(4-fluorophenyl)methanamine
2.1.2 InChI
InChI=1S/C7H8FN/c8-7-3-1-6(5-9)2-4-7/h1-4H,5,9H2
2.1.3 InChI Key
IIFVWLUQBAIPMJ-UHFFFAOYSA-N
2.1.4 Canonical SMILES
C1=CC(=CC=C1CN)F
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. 140-75-0

2. (4-fluorophenyl)methanamine

3. Benzenemethanamine, 4-fluoro-

4. P-fluorobenzylamine

5. Benzylamine, P-fluoro-

6. P-fluorobenzyl Amine

7. 4-fluoro-benzylamine

8. 1-(4-fluorophenyl)methanamine

9. 4-fluorobenzyl Amine

10. Chembl12392

11. Iifvwluqbaipmj-uhfffaoysa-n

12. Mfcd00008120

13. Sbb028215

14. (4-fluorophenyl)methylamine

15. 1tnh

16. 4-fluorbenzylamine

17. 4-flourobenzylamine

18. Einecs 205-430-4

19. P-fluoro Benzylamine

20. P-fluoro-benzylamine

21. 4-fluoro Benzylamine

22. 4-fluorobenzyl-amine

23. Nsc158269

24. Para Fluorobenzylamine

25. Para-fluorobenzylamine

26. 4-flourobenzyl Amine

27. Nsc 158269

28. Pubchem4420

29. 4-fluoro Benzyl Amine

30. 4-fluoro-benzyl Amine

31. Para-fluoro-benzylamine

32. (4-fluorobenzyl)amine

33. (4-fluorobenzyl) Amine

34. 4-fluorobenzenemethanamine

35. (4-fluoro-benzyl)-amine

36. 4-fluorobenzylamine 98%

37. 4-fluorobenzylamine, 97%

38. Ac1l27bc

39. Ac1q4ns3

40. Ac1q53yy

41. 4-fluoro-benzene Methanamine

42. Acmc-1c04h

43. Schembl21063

44. (4-fluorophenyl)-methanamine

45. (4-fluorophenyl)methan Amine

46. Aurora Ka-7685

47. Integrase Inhibitor, R1{2}

48. Ksc490g6j

49. Akos Akm00862

50. [(4-fluorophenyl)methyl]amine

51. (4-fluorophenyl)methanamine #

52. Paragos 510019

53. Schembl2532551

54. Rarechem Al Bw 0026

55. Benzylamine, P-fluoro- (8ci)

56. Dtxsid7059698

57. Ctk3j0364

58. Timtec-bb Sbb028215

59. Molport-000-145-984

60. Labotest-bb Ltbb000702

61. Zinc157595

62. Act01146

63. Ks-000009ez

64. Akos Bbs-00003618

65. Anw-20585

66. Bbl002457

67. Bdbm50113835

68. Ebd568184

69. Labotest-bb Lt03331223

70. Stk862565

71. Akos000120302

72. Ac-9771

73. As01938

74. Mcule-7721713397

75. Nsc-158269

76. Ps-9203

77. Rp19641

78. Rtc-063859

79. Tra0058611

80. Otava-bb 7020330617

81. Aj-15074

82. Ak-44528

83. An-43860

84. Br-44528

85. F117

86. Kb-38825

87. Or025498

88. Sc-01022

89. Db-000229

90. St2414345

91. Tc-063859

92. Tl8000911

93. Am20020467

94. F0252

95. Ft-0618437

96. St45255409

97. A22214

98. I01-0096

99. Q-200471

100. F2190-0390

101. 4-fluorophenyl)methanamine;4-fluoro-benzenemethanamin;benzylamine, P-fluoro-

2.3 Create Date
2005-03-26
3 Chemical and Physical Properties
Molecular Weight 125.146 g/mol
Molecular Formula C7H8FN
XLogP31.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Exact Mass125.064 g/mol
Monoisotopic Mass125.064 g/mol
Topological Polar Surface Area26 A^2
Heavy Atom Count9
Formal Charge0
Complexity77
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1
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