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    CAS 93246-53-8
    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
    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
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