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2D Structure
Also known as: 589-87-7, 4-bromoiodobenzene, Benzene, 1-bromo-4-iodo-, P-bromoiodobenzene, P-iodobromobenzene, 4-bromo-1-iodobenzene
Molecular Formula
C6H4BrI
Molecular Weight
282.90  g/mol
InChI Key
UCCUXODGPMAHRL-UHFFFAOYSA-N
FDA UNII
R9LDG2XS7C

1 2D Structure

2D Structure

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
1-bromo-4-iodobenzene
2.1.2 InChI
InChI=1S/C6H4BrI/c7-5-1-3-6(8)4-2-5/h1-4H
2.1.3 InChI Key
UCCUXODGPMAHRL-UHFFFAOYSA-N
2.1.4 Canonical SMILES
C1=CC(=CC=C1Br)I
2.2 Other Identifiers
2.2.1 UNII
R9LDG2XS7C
2.3 Synonyms
2.3.1 Depositor-Supplied Synonyms

1. 589-87-7

2. 4-bromoiodobenzene

3. Benzene, 1-bromo-4-iodo-

4. P-bromoiodobenzene

5. P-iodobromobenzene

6. 4-bromo-1-iodobenzene

7. P-bromophenyl Iodide

8. 4-iodobromobenzene

9. 1-bromo-4-iodo-benzene

10. 4-bromophenyl Iodide

11. 4-iodo-1-bromobenzene

12. Mfcd00001051

13. R9ldg2xs7c

14. Nsc-8033

15. Nsc8033

16. P-bromo Iodobenzene

17. Nsc 8033

18. 4-bromo Iodobenzene

19. 4-bromo-iodobenzene

20. 4-iodo Bromobenzene

21. 4-iodo-bromobenzene

22. Einecs 209-662-7

23. Para-bromoiodobenzene

24. 4-bromo-iodo-benzene

25. 1-bromo-4-iodobezene

26. 1-iodo-4-brombenzene

27. 1-iodo-4-bromobenzene

28. Ai3-09032

29. 1-bromo-4-iodo Benzene

30. 1-iodo-4-bromo-benzene

31. 4-bromo-1-iodo-benzene

32. 1-bromo-4-iodobenzene?

33. Unii-r9ldg2xs7c

34. Schembl24146

35. 1-bromanyl-4-iodanyl-benzene

36. 1-bromo-4-iodobenzene-[d4]

37. 1-bromo-4-iodobenzene, 98%

38. Dtxsid5060433

39. 1-bromo-4-iodobenzene-[13c6]

40. Zinc404761

41. Act05996

42. Ac-174

43. 1-bromo-4-iodo(?h?)benzene

44. Akos000185502

45. Cs-w008977

46. Gs-3007

47. Ol10130

48. Bp-13428

49. Sy005124

50. Db-027383

51. Am20040789

52. B0604

53. Bb 0268019

54. Ft-0617892

55. 589b877

56. A832097

57. J-504447

58. Z1695906764

2.4 Create Date
2005-03-26
3 Chemical and Physical Properties
Molecular Weight 282.90 g/mol
Molecular Formula C6H4BrI
XLogP34
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count0
Exact Mass281.85411 g/mol
Monoisotopic Mass281.85411 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