3-(trifluoromethyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-?]pyrazine hydrochloride - Uses, DMF, Dossier, Manufacturer, Supplier, Licensing, Distributer, Prices, News, GMP

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Also known as: 762240-92-6, 3-(trifluoromethyl)-5h,6h,7h,8h-[1,2,4]triazolo[4,3-a]pyrazine hydrochloride, 3-(trifluoromethyl)-5,6,7,8-tetrahydro-1,2,4-triazolo[4,3-a]pyrazine hydrochloride, Sitagliptin impurity 18, Y0of5kv5ka, Mfcd09817638

Molecular Formula

C₆H₈ClF₃N₄

Molecular Weight

228.60 g/mol

InChI Key

AQCSCRYRCRORET-UHFFFAOYSA-N

FDA UNII

Y0OF5KV5KA

1 2D Structure

3-(trifluoromethyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-α]pyrazine hydrochloride

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

3-(trifluoromethyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyrazine;hydrochloride

2.1.2 InChI

InChI=1S/C6H7F3N4.ClH/c7-6(8,9)5-12-11-4-3-10-1-2-13(4)5;/h10H,1-3H2;1H

2.1.3 InChI Key

AQCSCRYRCRORET-UHFFFAOYSA-N

2.1.4 Canonical SMILES

C1CN2C(=NN=C2C(F)(F)F)CN1.Cl

2.2 Other Identifiers

2.2.1 UNII

Y0OF5KV5KA

2.3 Synonyms

2.3.1 Depositor-Supplied Synonyms

1. 762240-92-6

2. 3-(trifluoromethyl)-5h,6h,7h,8h-[1,2,4]triazolo[4,3-a]pyrazine Hydrochloride

3. 3-(trifluoromethyl)-5,6,7,8-tetrahydro-1,2,4-triazolo[4,3-a]pyrazine Hydrochloride

4. Sitagliptin Impurity 18

5. Y0of5kv5ka

6. Mfcd09817638

7. 3-trifluoromethyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyrazine Hydrochloride

8. 3-trifluoromethyl-5,6,7,8-tetrahydro-1,2,4-triazolo-[4,3-a]pyrazine Hydrochloride

9. 3-(trifluoromethyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyrazine, Hcl

10. 3-(trifluoromethyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyrazine Hcl

11. 3-(trifluoromethyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyrazine;hydrochloride

12. 3-(trifluoromethyl)-5,6,7,8-tetrahydro-(1,2,4)triazolo(4,3-a)pyrazine Hydrochloride

13. 3-(trifluoromethyl)-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazine Hydrochloride

14. Sitagliptin Intermediates

15. Unii-y0of5kv5ka

16. Ec 616-309-4

17. Schembl332198

18. Dtxsid20474800

19. Bcp22639

20. Cs-m0692

21. 3-(trifluoromethyl)-1,2,4-triazolo[4,3-a]piperazine Hydrochloride

22. Ac-807

23. Rb3135

24. Sitagliptin Impurity 20 Hydrochloride

25. 3-(trifluoromethyl)-5,6,7,8-tetrahydro-1,2,4-triazolo-[4,3-a]pyrazine Hcl

26. Akos005063627

27. Ac-2623

28. Pb32770

29. 3-(trifluoromethyl)-5,6,7,8-tetrahydro(1,2,4)triazolo(4,3-a)pyrazine Hydrochloride (1:1)

30. As-19088

31. Sy002323

32. Am20100748

33. Ft-0656414

34. T2998

35. En300-82638

36. 240t926

37. A838647

38. Q-102525

39. 3-trifluoromethyl-[1,2,4]triazole[4,3-a]piperazinehydrochloride

40. 3-(trifluoromethyl)-1,2,4-triazolo[4,3-a]piperazine Hydrochloride, Aldrichcpr

41. 3-(trifluoromethyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-

42. A]pyrazine Hydrochloride

43. 3-(trifluoromethyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyrazinehydrochloride

44. 3-(trifluoromethyl)-5,6,7,8-tetrahydro-1,2,4-triazolo[4,3-a]pyrazine Hcl

45. 3-(trifluoromethyl)-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazine Hydrochloric Acid

46. 3-(trifluoromethyl)-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazine, Hydrochloride Salt

47. 3-(trifluoromethyl)-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-alpha]pyrazine Hydrochloride

48. 3-(trifluromethyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyrazine Hydrochloride

49. 3-trifluoromethyl-5,6,7,8-tetrahydro-1,2,4-triazolo[4,3-a]pyrazine Hydrochloride

50. 3-trifluoromethyl-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazine Hydrochloride

51. 1,2,4-triazolo(4,3-a)pyrazine, 5,6,7,8-tetrahydro-3-(trifluoromethyl)-, Hydrochloride (1:1)

52. 3-(trifluoromethyl)-5,6,7,8-tetrahydro-[1,2,4],triazolo[4,3-a]pyrazinehydrochloride

53. 3-(trifluoromethyl)-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazine--hydrogen Chloride (1/1)

54. 3-(trifluoromethyl)-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-alpha]pyrazine, Hydrochloride Salt

2.4 Create Date

2006-12-11

3 Chemical and Physical Properties

Molecular Formula	C₆H₈ClF₃N₄
Molecular Weight	228.60 g/mol
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	0
Exact Mass	228.0389585 g/mol
Monoisotopic Mass	228.0389585 g/mol
Topological Polar Surface Area	42.7 Å²
Heavy Atom Count	14
Formal Charge	0
Complexity	195
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	2