loader
Please Wait
Applying Filters...

Bora CDMO Bora CDMO

X
menu

    Market Place

    Market Place

    Post Enquiry

    Post Enquiry
    menu

    Technical details about MolPort-001-768-400, learn more about the structure, uses, toxicity, action, side effects and more

    Client Email Product
    Menu

    MolPort-001-768-400

    APIs // Active Pharmaceutical Ingredients

    PharmaCompass

    Phyton is a World Leader in Plant Cell Fermentation Technology and Commercial Manufacturing.

    Athena Pharmaceutiques is a Partner of Choice for Drug Delivery & Life Cycle Management.

    2D Structure
    1. Also known as: 14866-33-2, Tetra-n-octylammonium bromide, Tetraoctyl ammonium bromide, Tetraoctylazanium bromide, Tetra(n-octyl)ammonium bromide, Tetraoctylazanium;bromide
    Molecular Formula
    C32H68BrN
    Molecular Weight
    546.8  g/mol
    InChI Key
    QBVXKDJEZKEASM-UHFFFAOYSA-M
    FDA UNII
    52QW29OWOC
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    tetraoctylazanium;bromide
    2.1.2 InChI
    InChI=1S/C32H68N.BrH/c1-5-9-13-17-21-25-29-33(30-26-22-18-14-10-6-2,31-27-23-19-15-11-7-3)32-28-24-20-16-12-8-4;/h5-32H2,1-4H3;1H/q+1;/p-1
    2.1.3 InChI Key
    QBVXKDJEZKEASM-UHFFFAOYSA-M
    2.1.4 Canonical SMILES
    CCCCCCCC[N+](CCCCCCCC)(CCCCCCCC)CCCCCCCC.[Br-]
    2.2 Other Identifiers
    2.2.1 UNII
    52QW29OWOC
    2.3 Synonyms
    2.3.1 Depositor-Supplied Synonyms

    1. 14866-33-2

    2. Tetra-n-octylammonium Bromide

    3. Tetraoctyl Ammonium Bromide

    4. Tetraoctylazanium Bromide

    5. Tetra(n-octyl)ammonium Bromide

    6. Tetraoctylazanium;bromide

    7. 1-octanaminium, N,n,n-trioctyl-, Bromide

    8. Mfcd00011863

    9. 52qw29owoc

    10. Einecs 238-936-9

    11. Unii-52qw29owoc

    12. Toab

    13. Tetraoctylammoniumbromide

    14. Tetra-octylammonium Bromide

    15. Tetra-n-octylammoniumbromide

    16. Tetra Octyl Ammonium Bromide

    17. Dsstox_cid_14042

    18. Dsstox_rid_79108

    19. Dsstox_gsid_34042

    20. Schembl28062

    21. Tetraoctylammonium Bromide Purum

    22. Chembl1499545

    23. Dtxsid7034042

    24. Tox21_201028

    25. Ac2624

    26. Akos015833042

    27. Ammonium, Tetraoctyl-, Bromide

    28. Cs-w019360

    29. Gs-3229

    30. Jc10010

    31. N,n,n-trioctyloctan-1-aminium Bromide

    32. Ncgc00091022-01

    33. Ncgc00258581-01

    34. Sy010775

    35. Cas-14866-33-2

    36. Db-050368

    37. Ft-0653960

    38. T1603

    39. A808797

    40. Q7706628

    41. W-108100

    42. 1-octanaminium, N,n,n-trioctyl-, Bromide (1:1)

    43. 1-octanaminium, N,n,n-trioctyl-, Bromide;n,n,n-trioctyl-1-octanaminiumbromide;tetra-n-octylammonium Bromide;tetraoctylammonium Bromide;tetraoctyl Ammonium Bromide

    2.4 Create Date
    2005-07-19
    3 Chemical and Physical Properties
    Molecular Weight 546.8 g/mol
    Molecular Formula C32H68BrN
    Hydrogen Bond Donor Count0
    Hydrogen Bond Acceptor Count1
    Rotatable Bond Count28
    Exact Mass545.45351 g/mol
    Monoisotopic Mass545.45351 g/mol
    Topological Polar Surface Area0 Ų
    Heavy Atom Count34
    Formal Charge0
    Complexity281
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count2
    Post Enquiry
    POST ENQUIRY