CAS 10222-01-2

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Also known as: 10222-01-2, Dibromocyanoacetamide, 2,2-dibromo-3-nitrilopropionamide, Dbnpa, Acetamide, 2,2-dibromo-2-cyano-, 2-cyano-2,2-dibromoacetamide

Molecular Formula

C₃H₂Br₂N₂O

Molecular Weight

241.87 g/mol

InChI Key

UUIVKBHZENILKB-UHFFFAOYSA-N

FDA UNII

7N51QGL6MJ

1 2D Structure

CAS 10222-01-2

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

2,2-dibromo-2-cyanoacetamide

2.1.2 InChI

InChI=1S/C3H2Br2N2O/c4-3(5,1-6)2(7)8/h(H2,7,8)

2.1.3 InChI Key

UUIVKBHZENILKB-UHFFFAOYSA-N

2.1.4 Canonical SMILES

C(#N)C(C(=O)N)(Br)Br

2.2 Other Identifiers

2.2.1 UNII

7N51QGL6MJ

2.3 Synonyms

2.3.1 MeSH Synonyms

1. 2,2-dibromo-3-nitrilopropionamide

2.3.2 Depositor-Supplied Synonyms

1. 10222-01-2

2. Dibromocyanoacetamide

3. 2,2-dibromo-3-nitrilopropionamide

4. Dbnpa

5. Acetamide, 2,2-dibromo-2-cyano-

6. 2-cyano-2,2-dibromoacetamide

7. Xd-7287l Antimicrobial

8. 2,2-dibromo-2-carbamoylacetonitrile

9. Dibromocyano Acetic Acid Amide

10. Dibromonitrilopropionamide

11. Xd-1603

12. 7n51qgl6mj

13. Dtxsid5032361

14. Nsc-98283

15. Caswell No. 287aa

16. C3h2br2n2o

17. Nsc 98283

18. Dowicil Qk 20

19. Hsdb 6982

20. Xd 7287l

21. Einecs 233-539-7

22. Unii-7n51qgl6mj

23. Epa Pesticide Chemical Code 101801

24. Brn 1761192

25. 2,2-dibromo-2-cyano-acetamide

26. 2,2-dibromo-3-nitrilopropanamide

27. Acetamide, 2-cyano-2,2-dibromo-

28. Cyanodibromoacetamide

29. 2,2-dibromo-3-nitrilopropion Amide

30. Nciopen2_006184

31. Schembl23129

32. 3-02-00-01641 (beilstein Handbook Reference)

33. Acetamide,2-dibromo-2-cyano-

34. 2-cyano-2,2-dibromo-acetamide

35. Chembl1878278

36. Dow Antimicrobial 7287

37. Dtxcid3012361

38. Uuivkbhzenilkb-uhfffaoysa-n

39. Dibromocyanoacetamide [inci]

40. Nsc98283

41. Tox21_300089

42. Mfcd00129791

43. 2,2-dibromo-2-cyanoacetamide, 9ci

44. 2, 2-dibromo-2-carbamoylacetonitrile

45. 2,2-dibromo-2-cyanoacetamide, 96%

46. Akos015833850

47. 2,2-bis(bromanyl)-2-cyano-ethanamide

48. Ncgc00164203-01

49. Ncgc00164203-02

50. Ncgc00253921-01

51. As-12928

52. Cas-10222-01-2

53. Cs-0144768

54. D2902

55. Dibromo-3-nitrilopropionamide, 2,2-

56. Ft-0612090

57. 2,2-dibromo-3-nitrilo Propionamide (dbnpa)

58. H11778

59. 2,2-dibromo-3-nitrilopropionamide [hsdb]

60. A800546

61. Q-102771

62. Q5204411

63. Dbnpa; 2,2-dibromo-2-cyanoacetamide; 2,2-dibromo-2-carbamoylacetonitrile; 2,2-dibromo-3-nitrilopropionamide; Dbnpa

2.4 Create Date

2005-03-26

3 Chemical and Physical Properties

Molecular Formula	C₃H₂Br₂N₂O
Molecular Weight	241.87 g/mol
XLogP3	0.6
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Exact Mass	g/mol
Monoisotopic Mass	g/mol
Topological Polar Surface Area	66.9
Heavy Atom Count	8
Formal Charge	0
Complexity	156
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