CAS 5469-69-2

Chemistry

Chemistry

Also known as: 5469-69-2, 6-chloropyridazin-3-amine, 3-pyridazinamine, 6-chloro-, 6-amino-3-chloropyridazine, 6-chloro-3-pyridazinamine, 6-chloro-3-aminopyridazine

Molecular Formula

C₄H₄ClN₃

Molecular Weight

129.55 g/mol

InChI Key

DTXVKPOKPFWSFF-UHFFFAOYSA-N

FDA UNII

IJS443SLZG

1 2D Structure

CAS 5469-69-2

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

6-chloropyridazin-3-amine

2.1.2 InChI

InChI=1S/C4H4ClN3/c5-3-1-2-4(6)8-7-3/h1-2H,(H2,6,8)

2.1.3 InChI Key

DTXVKPOKPFWSFF-UHFFFAOYSA-N

2.1.4 Canonical SMILES

C1=CC(=NN=C1N)Cl

2.2 Other Identifiers

2.2.1 UNII

IJS443SLZG

2.3 Synonyms

2.3.1 Depositor-Supplied Synonyms

1. 5469-69-2

2. 6-chloropyridazin-3-amine

3. 3-pyridazinamine, 6-chloro-

4. 6-amino-3-chloropyridazine

5. 6-chloro-3-pyridazinamine

6. 6-chloro-3-aminopyridazine

7. Pyridazine, 3-amino-6-chloro-

8. Mfcd00051506

9. 3-chloro-6-pyridazinamine

10. Ijs443slzg

11. Nsc-25227

12. 6-chloropyridazin-3-amine;6-chloropyridazin-3-amine

13. 6-chloropyridazin-3-ylamine

14. 6-chloro-pyridazin-3-ylamine

15. Unii-ijs443slzg

16. Nsc25227

17. Einecs 226-796-1

18. Nsc 25227

19. Relugolix Impurity 4

20. 6-chloro-pyridazinamine

21. 3-amino-6-chlorpyridazine

22. 3-chloro-6-aminopyridazine

23. 6-chloro-3-pyridazineamine

24. 6-chloropyridazine-3-amine

25. 6-chloro-3-pyridazinylamine

26. 6-chloro-pyridazin-3-amine

27. Schembl38738

28. 3-amino-6-chloro Pyridazine

29. Dtxsid7063928

30. Chebi:169879

31. 3-amino-6-chloropyridazine, 97%

32. Bcp26649

33. Hy-y0141

34. Str03547

35. 3-amino-6-chloro-pyridazine

36. 3(s)-hydroxy-13-cis-eicosenoyl-coa

37. Akos000265600

38. Ac-2792

39. Cs-w019657

40. Pb30569

41. Ps-5236

42. Sdccgmls-0065854.p001

43. Sy002931

44. Db-006337

45. Db-263849

46. A1817

47. A7940

48. Am20100348

49. Ns00033177

50. En300-66006

51. Ac-907/25014022

52. J-512304

53. W-111724

54. Q27280758

55. Z56973924

2.4 Create Date

2005-03-26

3 Chemical and Physical Properties

Molecular Formula	C₄H₄ClN₃
Molecular Weight	129.55 g/mol
XLogP3	0.3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	0
Exact Mass	g/mol
Monoisotopic Mass	g/mol
Topological Polar Surface Area	51.8
Heavy Atom Count	8
Formal Charge	0
Complexity	77.7
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

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