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Also known as: 93246-53-8, 3-fluoro-4-morpholin-4-yl-phenylamine, 3-fluoro-4-(4-morpholinyl)aniline, 3-fluoro-4-morpholin-4-ylaniline, 3-fluoro-4-(morpholin-4-yl)aniline, 3-fluoro-4-morpholin-aniline
Molecular Formula
C10H13FN2O
Molecular Weight
196.22  g/mol
InChI Key
FQGIBHQUVCGEAC-UHFFFAOYSA-N
FDA UNII
S59MCD5UHX

CAS 93246-53-8
1 2D Structure

CAS 93246-53-8

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
3-fluoro-4-morpholin-4-ylaniline
2.1.2 InChI
InChI=1S/C10H13FN2O/c11-9-7-8(12)1-2-10(9)13-3-5-14-6-4-13/h1-2,7H,3-6,12H2
2.1.3 InChI Key
FQGIBHQUVCGEAC-UHFFFAOYSA-N
2.1.4 Canonical SMILES
C1COCCN1C2=C(C=C(C=C2)N)F
2.2 Other Identifiers
2.2.1 UNII
S59MCD5UHX
2.3 Synonyms
2.3.1 Depositor-Supplied Synonyms

1. 93246-53-8

2. 3-fluoro-4-morpholin-4-yl-phenylamine

3. 3-fluoro-4-(4-morpholinyl)aniline

4. 3-fluoro-4-morpholin-4-ylaniline

5. 3-fluoro-4-(morpholin-4-yl)aniline

6. 3-fluoro-4-morpholin-aniline

7. 3-fluoro-4-(4-morpholinyl)-benzeamine

8. Benzenamine, 3-fluoro-4-(4-morpholinyl)-

9. N-(4-amino-2-fluorophenyl)morpholine

10. S59mcd5uhx

11. 3-fluoro-4-(4-morpholinyl)benzenamine

12. 3-fluoro-4-morpholinobenzenamine

13. Mfcd02571270

14. 3-fluoro-4-(4-morpholinyl)-benzenamine

15. 3-fluoro-4-morpholine-anline

16. 3-fluoro-4-morpholino-aniline

17. 3-fluoro-4-morpholin-4-ylphenylamine

18. Unii-s59mcd5uhx

19. 3-fluoro4-morpholinylaniline

20. Oprea1_094439

21. Schembl209737

22. 3-fluoro-4-morpholinyl Aniline

23. 3-fluoro-4-morpholinyl-aniline

24. 3-luoro-4-morpholin-4-ylaniline

25. Dtxsid40363323

26. Chebi:182776

27. 3-fluoro-4-morpholin-4-yl Aniline

28. Albb-012803

29. Bcp08803

30. Cs-d1063

31. Zinc1399227

32. Stk346601

33. 4-(2-fluoro-4-aminophenyl)morpholine

34. Akos000103081

35. Ac-3076

36. Pb29205

37. (3-fluoro-4-morpholin-4-ylphenyl)amine

38. 3-fluoro-4-(4-morpholinyl) Benzenamine

39. Bp-13092

40. Sy003773

41. [3-fluoro-4-(4-morpholinyl)phenyl]amine

42. Am20060433

43. F0849

44. En300-67519

45. A13946

46. 3-fluoro-4-(4-morpholinyl)aniline, Aldrichcpr

47. 246f538

48. 7r-1199

49. J-512500

50. Z274553238

2.4 Create Date
2005-07-11
3 Chemical and Physical Properties
Molecular Weight 196.22 g/mol
Molecular Formula C10H13FN2O
XLogP31.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count1
Exact Mass196.10119120 g/mol
Monoisotopic Mass196.10119120 g/mol
Topological Polar Surface Area38.5 Ų
Heavy Atom Count14
Formal Charge0
Complexity185
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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