CAS 1575-37-7

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BUILDING BLOCK

1 Suppliers, 1 End Use APIs, 19 Related Intermediates

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1 End Use APIs
19 Related Intermediates

Chemistry

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Also known as: 1575-37-7, 4-bromo-1,2-benzenediamine, 4-bromo-1,2-diaminobenzene, 1,2-diamino-4-bromobenzene, 2-amino-4-bromoaniline, 4-bromo-o-phenylenediamine

Molecular Formula

C₆H₇BrN₂

Molecular Weight

187.04 g/mol

InChI Key

WIHHVKUARKTSBU-UHFFFAOYSA-N

FDA UNII

UKC7FT8YHS

1 2D Structure

CAS 1575-37-7

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

4-bromobenzene-1,2-diamine

2.1.2 InChI

InChI=1S/C6H7BrN2/c7-4-1-2-5(8)6(9)3-4/h1-3H,8-9H2

2.1.3 InChI Key

WIHHVKUARKTSBU-UHFFFAOYSA-N

2.1.4 Canonical SMILES

C1=CC(=C(C=C1Br)N)N

2.2 Other Identifiers

2.2.1 UNII

UKC7FT8YHS

2.3 Synonyms

2.3.1 Depositor-Supplied Synonyms

1. 1575-37-7

2. 4-bromo-1,2-benzenediamine

3. 4-bromo-1,2-diaminobenzene

4. 1,2-diamino-4-bromobenzene

5. 2-amino-4-bromoaniline

6. 4-bromo-o-phenylenediamine

7. 4-bromo-1,2-phenylenediamine

8. 1,2-benzenediamine, 4-bromo-

9. 4-bromo-2-aminoaniline

10. 2-amino-4-bromophenylamine

11. Ukc7ft8yhs

12. Mfcd02660622

13. 4-bromo-benzene-1,2-diamine

14. Nsc-285110

15. 3,4-diaminobromobenzene

16. Nsc285110

17. 4-bromophenylenediamine

18. Unii-ukc7ft8yhs

19. 4-bromo-phenylene Diamine

20. 4-bromo-phenylene-diamine

21. P-bromo-o-phenylenediamine

22. Ec 629-615-8

23. 4-bromobenzene1,2-diamine

24. 4-bromo-o-phenylene Diamine

25. 1-bromo-3,4-diaminobenzene

26. 4-bromo-1,2,diaminobenzene

27. 4-bromo1,2-diamino Benzene

28. Schembl13663

29. 1,2-diamino-4-bromo Benzene

30. 4-bromo 1,2-diamino Benzene

31. 4-bromo-1,2-diamino Benzene

32. 4-bromobenzene-1,2- Diamine

33. 4 -bromobenzene-1,2-diamine

34. Dtxsid80314531

35. Zinc158488

36. Act03072

37. Albb-006246

38. Bcp08763

39. Str08518

40. 4-bromo-1,2-diaminobenzene, 97%

41. Bbl104411

42. Stk503784

43. Akos005145534

44. Ab11949

45. Ac-7570

46. Am61789

47. Ccg-302578

48. Cs-w008701

49. Nsc 285110

50. Ps-4239

51. Bp-13077

52. Sy002835

53. Db-028725

54. A3462

55. B3181

56. Bb 0241823

57. Ft-0617697

58. En300-45066

59. Aq-358/42003067

60. J-009422

61. J-514803

62. Z385438802

63. 4-bromo-o-phenyle Pound>>1,2-diamino-4-bromobenzene Pound>>4-bromo-1,2-phenylenediamine

2.4 Create Date

2005-03-26

3 Chemical and Physical Properties

Molecular Formula	C₆H₇BrN₂
Molecular Weight	187.04 g/mol
XLogP3	1.3
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Exact Mass	g/mol
Monoisotopic Mass	g/mol
Topological Polar Surface Area	52
Heavy Atom Count	9
Formal Charge	0
Complexity	97.1
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	1