Please Wait
Applying Filters...
menu
    • menu
    munit-sa-m-2025-04-14

    Virtual Booth

    Contact Supplier

    Polpharma is a Polish CDMO of APIs and a significant European API producer, delivering products to companies worldwide.

    Virtual Booth

    Contact Supplier

    SPI Pharma has been solving formulation challenges using superior functional materials.

    Virtual Booth

    Contact Supplier

    Granules India Limited has high volume world-class facilities for APIs, PFIs, & FDFs, serving customers in over 80 countries.

    Virtual Booth

    Contact Supplier

    Suanfarma, at the Core of a Better Life.

    Virtual Booth

    Contact Supplier

    xyz-pharma-m-2025-04-14

    Virtual Booth

    Contact Supplier

    Menu

    CAS 399-72-4

    BUILDING BLOCK

    PharmaCompass
    Xls

    Filters

    clear-filterReset all filters
    2D Structure
    Also known as: 399-72-4, 5-fluoro-2-methyl-1h-indole, 1h-indole, 5-fluoro-2-methyl-, Mfcd02093649, 2-methyl-5-fluoroindole, 5-fluoro-2-methyl indole
    Molecular Formula
    C9H8FN
    Molecular Weight
    149.16  g/mol
    InChI Key
    JJIUISYYTFDATN-UHFFFAOYSA-N
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    5-fluoro-2-methyl-1H-indole
    2.1.2 InChI
    InChI=1S/C9H8FN/c1-6-4-7-5-8(10)2-3-9(7)11-6/h2-5,11H,1H3
    2.1.3 InChI Key
    JJIUISYYTFDATN-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    CC1=CC2=C(N1)C=CC(=C2)F
    2.2 Synonyms
    2.2.1 Depositor-Supplied Synonyms

    1. 399-72-4

    2. 5-fluoro-2-methyl-1h-indole

    3. 1h-indole, 5-fluoro-2-methyl-

    4. Mfcd02093649

    5. 2-methyl-5-fluoroindole

    6. 5-fluoro-2-methyl Indole

    7. 5-fluoro-2-methyl-indole

    8. Schembl12433

    9. 5-fluoro-2-methylindole, 97%

    10. Dtxsid30381091

    11. Kuc106615n

    12. Zinc403325

    13. Ksc-09-215d

    14. Akos005258120

    15. Cs-w007738

    16. Pb29177

    17. Ps-6821

    18. Db-012447

    19. A6672

    20. Am20050248

    21. F1047

    22. Ft-0602023

    23. J3.660.199j

    24. F-5913

    25. Z1655104238

    2.3 Create Date
    2005-07-19
    3 Chemical and Physical Properties
    Molecular Weight 149.16 g/mol
    Molecular Formula C9H8FN
    XLogP32.1
    Hydrogen Bond Donor Count1
    Hydrogen Bond Acceptor Count1
    Rotatable Bond Count0
    Exact Mass149.064077422 g/mol
    Monoisotopic Mass149.064077422 g/mol
    Topological Polar Surface Area15.8 Ų
    Heavy Atom Count11
    Formal Charge0
    Complexity149
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1