CAS 86404-63-9 manufacturers and suppliers on PharmaCompass

PharmaCompass

Chemistry

Click the arrow to open the dropdown
read-moreClick the button for full data set
Also known as: 86404-63-9, 2,4-difluoro-alpha-(1h-1,2,4-triazolyl)acetophenone, 1-(2,4-difluorophenyl)-2-(1,2,4-triazol-1-yl)ethanone, 2',4'-difluoro-2-(1h-1,2,4-triazol-1-yl)acetophenone, Ethanone, 1-(2,4-difluorophenyl)-2-(1h-1,2,4-triazol-1-yl)-, 2-(1h-1,2,4-triazol-1-yl)-2',4'-difluoroacetophenone
Molecular Formula
C10H7F2N3O
Molecular Weight
223.18  g/mol
InChI Key
XCHRPVARHBCFMJ-UHFFFAOYSA-N
FDA UNII
HXI8R9R915

CAS 86404-63-9
1 2D Structure

CAS 86404-63-9

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
1-(2,4-difluorophenyl)-2-(1,2,4-triazol-1-yl)ethanone
2.1.2 InChI
InChI=1S/C10H7F2N3O/c11-7-1-2-8(9(12)3-7)10(16)4-15-6-13-5-14-15/h1-3,5-6H,4H2
2.1.3 InChI Key
XCHRPVARHBCFMJ-UHFFFAOYSA-N
2.1.4 Canonical SMILES
C1=CC(=C(C=C1F)F)C(=O)CN2C=NC=N2
2.2 Other Identifiers
2.2.1 UNII
HXI8R9R915
2.3 Synonyms
2.3.1 Depositor-Supplied Synonyms

1. 86404-63-9

2. 2,4-difluoro-alpha-(1h-1,2,4-triazolyl)acetophenone

3. 1-(2,4-difluorophenyl)-2-(1,2,4-triazol-1-yl)ethanone

4. 2',4'-difluoro-2-(1h-1,2,4-triazol-1-yl)acetophenone

5. Ethanone, 1-(2,4-difluorophenyl)-2-(1h-1,2,4-triazol-1-yl)-

6. 2-(1h-1,2,4-triazol-1-yl)-2',4'-difluoroacetophenone

7. Uk 51060

8. Hxi8r9r915

9. Voriconazole Related Compound C

10. Mfcd02093825

11. 1-(2,4-difluorophenyl)-2-(1h-1,2,4-triazol-1-yl)ethan-1-one

12. Fluconazole Related Compound (2,4-difluoro-alpha-(1h-1,2,4-triazolyl)acetophenone)

13. Unii-hxi8r9r915

14. Ec 617-850-9

15. 1-(2,4-difluorophenacyl)-1h-1,2,4-triazole

16. Schembl76005

17. Mls000681496

18. 1-(2,4-difluorobenzoylmethyl)-1h-1,2,4-triazole

19. 2,4-difluoro-

20. A-(1h-1,2,4-triazolyl)acetophenone

21. F2158-0485

22. Chembl2063495

23. Dtxsid70235529

24. Hms2555a08

25. Bcp08801

26. Zinc4008794

27. Am1204

28. Akos005208156

29. Ac-5336

30. Cs-w013099

31. Ds-10468

32. Smr000269159

33. Sy013731

34. Uk-51060

35. Fluconazole Impurity E [ep Impurity]

36. Ft-0642042

37. T2722

38. Voriconazole Impurity A [ep Impurity]

39. A19245

40. O10251

41. Voriconazole Related Compound C [usp-rs]

42. 867d756

43. Sr-01000492477

44. 2,4-difluoro-?-(1h-1,2,4-triazolyl)acetophenone

45. Q-200187

46. Sr-01000492477-1

47. Q27280148

48. Voriconazole Related Compound C [usp Impurity]

49. 2,4-difluoro- Alpha -(1h-1,2,4-triazolyl)acetophenone

50. 2,4-difluoro-2-(1h-1,2,4-triazol-1-yl)acetophenone

51. 2,4-difluorophenyl-2-(1h-1,2,4-triazol-1-yl)ethanone

52. 1-(2,4-difluorophenyl)-2-(1h-1,2,4-triazol-1-yl) Ethanone

53. 2',4'-difluoro-2-(1,2,4-triazol-1-yl)acetophenone

54. 2',4'-difluoro-alpha-(1h-1,2,4-triazol-1-yl)acetophenone

55. 2,4-difluoro-alpha-(1h-1,2,4-triazolyl)acetophenone, 95%

56. 2-(1h-1,2,4-triazol-1-yl)-2\',4\'-difluoroacetophenone

57. 1-(2,4-difluoro Phenyl)-2-(1h-1,2,4-triazole-1-yl)ethanone

58. 1-(2,4-difluoro-phenyl)-2-[1,2,4]triazol-1-yl-ethanone

59. 1-(2,4-difluorophenyl)-2-(1h-1,2,4-triazol-1-yl)-1-ethanone

60. 2,4-difluoro-.alpha.-(1h-1,2,4-triazolyl)acetophenone

61. Voriconazole Related Compound C, United States Pharmacopeia (usp) Reference Standard

62. 1-(2,4-difluorophenyl)-2-(1h-1,2,4-triazol-1-yl)ethanone;2,4-difluoro-2(1h-1,2,4-triazol-1-yl)acetophenone

63. 2 Inverted Exclamation Mark ,4 Inverted Exclamation Mark -difluoro-2-(1h-1,2,4-triazol-1-yl)acetophenone

2.4 Create Date
2005-03-27
3 Chemical and Physical Properties
Molecular Weight 223.18 g/mol
Molecular Formula C10H7F2N3O
XLogP31.7
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count3
Exact Mass223.05571818 g/mol
Monoisotopic Mass223.05571818 g/mol
Topological Polar Surface Area47.8 Ų
Heavy Atom Count16
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

Upload your portfolio for free, ask us

END USE APIs

read-more
read-more

MARKET PLACE

Do you need sourcing support? Ask us
Ask Us for Pharmaceutical Supplier and Partner
Ask Us, Find A Supplier / Partner
No Commissions, No Strings Attached, Get Connected for FREE

What are you looking for?

How can we help you?

The request can't be empty

Please read our Privacy Policy carefully

You must agree to the privacy policy

The name can't be empty
The company can't be empty.
The email can't be empty Please enter a valid email.
The mobile can't be empty