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2D Structure
Also known as: N-amyl bromide, Amyl bromide, Pentane, 1-bromo-, 1-bromo-pentane, N-c5h11br, Nsc 7895
Molecular Formula
C5H11Br
Molecular Weight
151.04  g/mol
InChI Key
YZWKKMVJZFACSU-UHFFFAOYSA-N
FDA UNII
Z2S4R599P0

1-Bromopentane has been reported in Fucus vesiculosus with data available.
1 2D Structure

2D Structure

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
1-bromopentane
2.1.2 InChI
InChI=1S/C5H11Br/c1-2-3-4-5-6/h2-5H2,1H3
2.1.3 InChI Key
YZWKKMVJZFACSU-UHFFFAOYSA-N
2.2 Other Identifiers
2.2.1 UNII
Z2S4R599P0
2.3 Synonyms
2.3.1 MeSH Synonyms

1. 1-bpt Cpd

2.3.2 Depositor-Supplied Synonyms

1. N-amyl Bromide

2. Amyl Bromide

3. Pentane, 1-bromo-

4. 1-bromo-pentane

5. N-c5h11br

6. Nsc 7895

7. Einecs 203-776-0

8. Unii-z2s4r599p0

9. Dtxsid3049203

10. Ai3-17813

11. Z2s4r599p0

12. Nsc-7895

13. N-amyl Bromide [mi]

14. Dtxcid8028474

15. Ec 203-776-0

16. 1bromopentane

17. Npentyl Bromide

18. 1pentyl Bromide

19. Pentane, 1bromo

20. 1-bpt Cpd

21. 203-776-0

22. Inchi=1/c5h11br/c1-2-3-4-5-6/h2-5h2,1h

23. Un1993

24. Yzwkkmvjzfacsu-uhfffaoysa-n

25. 110-53-2

26. Pentyl Bromide

27. 1-pentyl Bromide

28. N-pentyl Bromide

29. Pentane, Bromo-

30. 1-bromo Pentane

31. 29756-38-5

32. 1-bromopentane--d4

33. Mfcd00000267

34. 1-bromopentane--d9

35. 1-pentylbromide

36. 1-bromopentane-1,1-d2

37. Amylbromide

38. Brompentane

39. Pentylbromide

40. Bromoethylpropan

41. N-pentylbromide

42. 5-bromopentane

43. 1-bromanylpentane

44. 1-bromo-n-pentane

45. 1-bromopentane, 98%

46. 1-bromo-4 -methylbutane

47. Schembl11305

48. Chembl155850

49. N-amyl Bromide, Pentyl Bromide

50. Nsc7895

51. Tox21_202717

52. Stl280346

53. Akos000118764

54. Fb75318

55. Ncgc00260265-01

56. 5br

57. As-10532

58. Cas-110-53-2

59. 1-bromopentane, Purum, >=98.5% (gc)

60. B0628

61. Ns00005529

62. En300-19290

63. A802210

64. Q19630814

65. F1908-0121

2.4 Create Date
2005-03-26
3 Chemical and Physical Properties
Molecular Weight 151.04 g/mol
Molecular Formula C5H11Br
XLogP33.4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count3
Exact Mass Da
Monoisotopic Mass Da
Topological Polar Surface Area0
Heavy Atom Count6
Formal Charge0
Complexity19.9
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1