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    Technical details about CAS 915087-25-1, learn more about the structure, uses, toxicity, action, side effects and more

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    CAS 915087-25-1

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    2D Structure
    Also known as: 915087-25-1, Enzalutamide its-3, Benzamide, 4-amino-2-fluoro-n-methyl-, N-methyl-2-fluoro-4-aminobenzamide, Y2h4hb3fql, Mfcd09909322
    Molecular Formula
    C8H9FN2O
    Molecular Weight
    168.17  g/mol
    InChI Key
    XOKAXPQJUODMSH-UHFFFAOYSA-N
    FDA UNII
    Y2H4HB3FQL
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    4-amino-2-fluoro-N-methylbenzamide
    2.1.2 InChI
    InChI=1S/C8H9FN2O/c1-11-8(12)6-3-2-5(10)4-7(6)9/h2-4H,10H2,1H3,(H,11,12)
    2.1.3 InChI Key
    XOKAXPQJUODMSH-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    CNC(=O)C1=C(C=C(C=C1)N)F
    2.2 Other Identifiers
    2.2.1 UNII
    Y2H4HB3FQL
    2.3 Synonyms
    2.3.1 Depositor-Supplied Synonyms

    1. 915087-25-1

    2. Enzalutamide Its-3

    3. Benzamide, 4-amino-2-fluoro-n-methyl-

    4. N-methyl-2-fluoro-4-aminobenzamide

    5. Y2h4hb3fql

    6. Mfcd09909322

    7. Unii-y2h4hb3fql

    8. Schembl547746

    9. Amy6472

    10. Dtxsid90657628

    11. 2-fluoro-4-amino-n-methylbenzamide

    12. 4-amino-n-methyl-2-fluorobenzamide

    13. Bcp12301

    14. Cs-m1520

    15. N-methyl 4-amino-2-fluorobenzamide

    16. Ab3026

    17. Zinc43570450

    18. 4-amino-2-fluoro-n-methyl-benzamide

    19. N-methyl-2-fluoro-4 -aminobenzamide

    20. Akos010976925

    21. Benzamide,4-amino-2-fluoro-n-methyl-

    22. Ds-5089

    23. Ac-29989

    24. Sy111564

    25. 4-?amino-?2-?fluoro-?n-?methylbenzamide

    26. Db-079058

    27. Ft-0737732

    28. A24304

    29. 4-amino-2-fluoro-n-methylbenzamide;2-fluoro-n-methyl-4-nitrobenzamide

    2.4 Create Date
    2009-08-10
    3 Chemical and Physical Properties
    Molecular Weight 168.17 g/mol
    Molecular Formula C8H9FN2O
    XLogP30.6
    Hydrogen Bond Donor Count2
    Hydrogen Bond Acceptor Count3
    Rotatable Bond Count1
    Exact Mass168.06989108 g/mol
    Monoisotopic Mass168.06989108 g/mol
    Topological Polar Surface Area55.1 Ų
    Heavy Atom Count12
    Formal Charge0
    Complexity174
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1