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Also known as: 6969-71-7, [1,2,4]triazolo[4,3-a]pyridin-3(2h)-one, 2h-[1,2,4]triazolo[4,3-a]pyridin-3-one, 1,2,4-triazolo(4,3-a)pyridin-3(2h)-one, [1,2,4]triazolo[4,3-a]pyridin-3-ol, J5ewp6l1va
Molecular Formula
C6H5N3O
Molecular Weight
135.12  g/mol
InChI Key
LJRXNXBFJXXRNQ-UHFFFAOYSA-N
FDA UNII
J5EWP6L1VA

CAS 6969-71-7
1 2D Structure

CAS 6969-71-7

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
2H-[1,2,4]triazolo[4,3-a]pyridin-3-one
2.1.2 InChI
InChI=1S/C6H5N3O/c10-6-8-7-5-3-1-2-4-9(5)6/h1-4H,(H,8,10)
2.1.3 InChI Key
LJRXNXBFJXXRNQ-UHFFFAOYSA-N
2.1.4 Canonical SMILES
C1=CC2=NNC(=O)N2C=C1
2.2 Other Identifiers
2.2.1 UNII
J5EWP6L1VA
2.3 Synonyms
2.3.1 Depositor-Supplied Synonyms

1. 6969-71-7

2. [1,2,4]triazolo[4,3-a]pyridin-3(2h)-one

3. 2h-[1,2,4]triazolo[4,3-a]pyridin-3-one

4. 1,2,4-triazolo(4,3-a)pyridin-3(2h)-one

5. [1,2,4]triazolo[4,3-a]pyridin-3-ol

6. J5ewp6l1va

7. 1,2,4-triazolo[4,3-a]pyridine-3(2h)-one

8. 2h,3h-[1,2,4]triazolo[4,3-a]pyridin-3-one

9. 3-hydroxytriazolo[4,3-a]pyridine

10. Mfcd00022632

11. Nsc-68462

12. 3-hydroxytriazolo(4,3-a)pyridine

13. S-triazolo[4,3-a]pyridin-3-ol

14. Nsc68462

15. Einecs 230-191-8

16. Nsc 68462

17. Unii-j5ewp6l1va

18. 1,2,4-triazolo-[4,3,a]pyridin-3(2h)-one

19. Ec 230-191-8

20. Mls006011497

21. Schembl103370

22. 1,2,4-triazolopyridin-3-one

23. Ljrxnxbfjxxrnq-uhfffaoysa-

24. Dtxsid70219980

25. Hms1755a19

26. Bcp03573

27. Zinc2654018

28. Akos000121574

29. Akos004910247

30. Ac-7639

31. Gf-0127

32. Triazolopyridinone [usp Impurity]

33. 124-triazolo[43-a]pyridin-3(2h)-one

34. Smr004703276

35. Sy036845

36. 1,4-triazolo[4,3-a]pyridin-3(2h)-one

37. Db-018728

38. 1,2,4-triazolo[4,3a]pyridin-3(2h)-one

39. 3-hydroxy-1,2,4-triazolo[4,3-a]pyridine

40. A9218

41. Am20061449

42. Cs-0046232

43. Ft-0606247

44. T1667

45. 2h-[1,2,4]triazolo[4,5-a]pyridin-3-one

46. 1,2,4-triazolo[4,3-a]pyridin-3(2h)-one,

47. 69t717

48. F14880

49. [1,2,4]triazolo[4,3-a]pyridin-3(2h);-one

50. [1,2,4]triazolo[4,3-a]pyridin-3-(2h)-one

51. Sr-01000945133

52. Sr-01000945133-1

53. W-104602

54. 1,2,4-triazolo[4,3-a]pyridin-3(2h)-one, 97%

55. 2,4-dihydro-[1,2,4]triazolo[4,5-a]pyridin-3-one

56. Z56987654

57. F2113-0215

58. F3095-0220

2.4 Create Date
2005-03-26
3 Chemical and Physical Properties
Molecular Weight 135.12 g/mol
Molecular Formula C6H5N3O
XLogP30
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Exact Mass135.043261791 g/mol
Monoisotopic Mass135.043261791 g/mol
Topological Polar Surface Area44.7 Ų
Heavy Atom Count10
Formal Charge0
Complexity264
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1

BUILDING BLOCK

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