Please Wait
Applying Filters...
Menu
Xls
2D Structure
Also known as: 4-bromofluorobenzene, 460-00-4, 4-fluorobromobenzene, P-bromofluorobenzene, P-fluorobromobenzene, Benzene, 1-bromo-4-fluoro-
Molecular Formula
C6H4BrF
Molecular Weight
175.00  g/mol
InChI Key
AITNMTXHTIIIBB-UHFFFAOYSA-N
FDA UNII
A7ZH69I3KH

1 2D Structure

2D Structure

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
1-bromo-4-fluorobenzene
2.1.2 InChI
InChI=1S/C6H4BrF/c7-5-1-3-6(8)4-2-5/h1-4H
2.1.3 InChI Key
AITNMTXHTIIIBB-UHFFFAOYSA-N
2.1.4 Canonical SMILES
C1=CC(=CC=C1F)Br
2.2 Other Identifiers
2.2.1 UNII
A7ZH69I3KH
2.3 Synonyms
2.3.1 Depositor-Supplied Synonyms

1. 4-bromofluorobenzene

2. 460-00-4

3. 4-fluorobromobenzene

4. P-bromofluorobenzene

5. P-fluorobromobenzene

6. Benzene, 1-bromo-4-fluoro-

7. 4-fluorophenyl Bromide

8. 1-fluoro-4-bromobenzene

9. 4-fluoro-1-bromobenzene

10. P-fluorophenyl Bromide

11. 4-bromo-1-fluorobenzene

12. 1-bromo-4-fluoro Benzene

13. Nsc 10268

14. 4-fluoro Bromobenzene

15. A7zh69i3kh

16. 1-bromanyl-4-fluoranyl-benzene

17. Nsc-9460

18. Nsc-10268

19. Dsstox_cid_7153

20. Bromo Fluorobenzene

21. Dsstox_rid_78327

22. Dsstox_gsid_27153

23. 4-fluorobromobenzene;p-bromofluorobenzene;4-bromofluorobenzene

24. Cas-460-00-4

25. Einecs 207-300-2

26. Mfcd00000342

27. 1-bromo-4-fluoro-benzene

28. Unii-a7zh69i3kh

29. Ccris 9387

30. P-bromoflurobenzene

31. Parabromofluorobezene

32. P-bromo-fluorobenzene

33. 4-bromo Flourobenzene

34. 4-bromo-fluorobenzene

35. 4-fluoro-bromobenzene

36. 1-bromo4-fluorobenzene

37. 4-bromo-fluoro-benzene

38. 1-bromo-4-fluorbenzene

39. 4-fluoro-phenyl-bromide

40. 1-bromo-4-flurobenzene

41. 1-bromo- 4-fluorobenzene

42. 4-bromo-1-fluoro Benzene

43. Ec 207-300-2

44. Schembl1622

45. P-bromophenyl Fluoride

46. 4-bromophenyl Fluoride

47. 4-fluorobenzene Bromide

48. Chembl1876826

49. Dtxsid4027153

50. 1-bromo-4-fluorobenzene, 99%

51. Nsc9460

52. Chebi:141551

53. Zinc402617

54. Bcp24440

55. Cs-d1104

56. Nsc10268

57. Tox21_201379

58. Tox21_303305

59. Akos000120007

60. Am10649

61. 4-bromofluorobenzene, Analytical Standard

62. Ncgc00164249-01

63. Ncgc00164249-02

64. Ncgc00257136-01

65. Ncgc00258930-01

66. Bp-21440

67. Ps-11962

68. B0884

69. Ft-0617889

70. 4-bromofluorobenzene 10 Microg/ml In Methanol

71. D84750

72. 4-bromofluorobenzene 2000 Microg/ml In Methanol

73. J-514816

74. Q18049954

75. 4-bromofluorobenzene (bfb) 2000 Microg/ml In Methanol

76. 4-bromofluorobenzene (bfb) 2500 Microg/ml In Methanol

77. F0001-1247

78. 4-bromofluorobenzene (bfb) 10000 Microg/ml In Methanol

79. Y87

2.4 Create Date
2005-03-26
3 Chemical and Physical Properties
Molecular Weight 175.00 g/mol
Molecular Formula C6H4BrF
XLogP33.2
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Exact Mass173.94804 g/mol
Monoisotopic Mass173.94804 g/mol
Topological Polar Surface Area0 Ų
Heavy Atom Count8
Formal Charge0
Complexity66.9
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1