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    Chemistry

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    Also known as: 1119-97-7, Myristyltrimethylammonium bromide, Tetradecyltrimethylammonium bromide, Tetradonium bromide, Mitmab, N,n,n-trimethyltetradecan-1-aminium bromide
    Molecular Formula
    C17H38BrN
    Molecular Weight
    336.4  g/mol
    InChI Key
    CXRFDZFCGOPDTD-UHFFFAOYSA-M
    FDA UNII
    8483H94W1E
    Cetrimide
    1 2D Structure

    Cetrimide

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    trimethyl(tetradecyl)azanium;bromide
    2.1.2 InChI
    InChI=1S/C17H38N.BrH/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18(2,3)4;/h5-17H2,1-4H3;1H/q+1;/p-1
    2.1.3 InChI Key
    CXRFDZFCGOPDTD-UHFFFAOYSA-M
    2.1.4 Canonical SMILES
    CCCCCCCCCCCCCC[N+](C)(C)C.[Br-]
    2.2 Other Identifiers
    2.2.1 UNII
    8483H94W1E
    2.3 Synonyms
    2.3.1 MeSH Synonyms

    1. C14qac

    2. Catrimox-14

    3. Myristyl Trimethylammonium Bromide

    4. Tdtma Cpd

    5. Tetradecyl-trimethylammonium Bromide

    6. Tetradecyltrimethylammonium

    7. Tetradecyltrimethylammonium Bromide

    8. Tetradecyltrimethylammonium Chloride

    9. Tetradecyltrimethylammonium Hydroxide

    10. Tetradecyltrimethylammonium Iodide

    11. Tetradecyltrimethylammonium Mesylate

    12. Tetradecyltrimethylammonium Oxalate

    13. Trimethyl Tetradecyl Ammonium Bromide

    14. Trimethyltetradecylammonium Bromide

    15. Ttab Cpd

    2.3.2 Depositor-Supplied Synonyms

    1. 1119-97-7

    2. Myristyltrimethylammonium Bromide

    3. Tetradecyltrimethylammonium Bromide

    4. Tetradonium Bromide

    5. Mitmab

    6. N,n,n-trimethyltetradecan-1-aminium Bromide

    7. Tetradecyl Trimethyl Ammonium Bromide

    8. Mytab

    9. Myrtrimonium Bromide

    10. 8044-71-1

    11. Ttab

    12. Trimethyl(tetradecyl)azanium;bromide

    13. Tetradonium Bromide [inn]

    14. 1-tetradecanaminium, N,n,n-trimethyl-, Bromide

    15. Trimethyl(tetradecyl)ammonium Bromide

    16. Ammonium, Trimethyltetradecyl-, Bromide

    17. Trimethyltetradecylammonium Bromide

    18. Trimethyl(tetradecyl)azanium Bromide

    19. Mtab

    20. Chebi:3565

    21. Tetradecyltrimethylammonium (bromide)

    22. 8483h94w1e

    23. 1-tetradecanaminium, N,n,n-trimethyl-, Bromide (1:1)

    24. Morpan T

    25. Quaternium 13

    26. Dsstox_cid_24367

    27. Dsstox_rid_80175

    28. Dsstox_gsid_44367

    29. Myrtrimonium Bromide;cetrimide Bp; Mtab; Microcide Ii; Morpan T;

    30. Chembl113150

    31. Tetradonio Bromuro

    32. Tetradonio Bromuro [dcit]

    33. Tetradonii Bromidum

    34. Mfcd00011770

    35. Cas-1119-97-7

    36. Bromuro De Tetradonio

    37. Trimethylmyristylammonium Bromide

    38. Bromure De Tetradonium

    39. Tetradonii Bromidum [inn-latin]

    40. Ncgc00166121-01

    41. Einecs 214-291-9

    42. Bromure De Tetradonium [inn-french]

    43. Bromuro De Tetradonio [inn-spanish]

    44. Quammonium

    45. N,n,n-trimethyl-1-tetradecanaminium Bromide

    46. Cetrimide Bromide

    47. Unii-8483h94w1e

    48. Myristyl Trimethyl Ammonium Bromide

    49. N-tetradecyltrimethylammonium Bromide

    50. Dynamin Inhibitor Ii

    51. Sumquat 6110

    52. (1-tetradecyl)trimethylammonium Bromide

    53. Ammonium, Tetradecyltrimethyl-, Bromide

    54. Ec 214-291-9

    55. Schembl59988

    56. Myristyltrimethylaminium Bromide

    57. Dtxsid0044367

    58. Rhodaquat M-214c/99

    59. Tetradecyltrimethylammmonium Bromide

    60. Myrtrimonium Bromide [inci]

    61. Hy-d0839

    62. Trimethyltetradecyl Ammonium Bromide

    63. Tox21_112327

    64. Tox21_302067

    65. Akos015907427

    66. Tox21_112327_1

    67. Jc10043

    68. Ncgc00166121-03

    69. Ncgc00255707-01

    70. As-12887

    71. N,n,n-trimethyltetradecan-1-aminiumbromide

    72. Db-050409

    73. B7620

    74. Cs-0014809

    75. Ft-0604996

    76. Myristyltrimethylammonium Bromide [mi]

    77. T0906

    78. (1-tetradecyl)trimethylammonium Bromide, 98%

    79. D02164

    80. F21408

    81. T-6750

    82. A802464

    83. A839915

    84. Q27106133

    2.4 Create Date
    2005-06-24
    3 Chemical and Physical Properties
    Molecular Weight 336.4 g/mol
    Molecular Formula C17H38BrN
    Hydrogen Bond Donor Count0
    Hydrogen Bond Acceptor Count1
    Rotatable Bond Count13
    Exact Mass335.21876 g/mol
    Monoisotopic Mass335.21876 g/mol
    Topological Polar Surface Area0 Ų
    Heavy Atom Count19
    Formal Charge0
    Complexity158
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count2
    4 Pharmacology and Biochemistry
    4.1 MeSH Pharmacological Classification

    Detergents

    Purifying or cleansing agents, usually salts of long-chain aliphatic bases or acids, that exert cleansing (oil-dissolving) and antimicrobial effects through a surface action that depends on possessing both hydrophilic and hydrophobic properties. (See all compounds classified as Detergents.)

    Surface-Active Agents

    Agents that modify interfacial tension of water; usually substances that have one lipophilic and one hydrophilic group in the molecule; includes soaps, detergents, emulsifiers, dispersing and wetting agents, and several groups of antiseptics. (See all compounds classified as Surface-Active Agents.)

    4.2 ATC Code

    D - Dermatologicals

    D08 - Antiseptics and disinfectants

    D08A - Antiseptics and disinfectants

    D08AJ - Quaternary ammonium compounds

    D08AJ04 - Cetrimide

    D - Dermatologicals

    D11 - Other dermatological preparations

    D11A - Other dermatological preparations

    D11AC - Medicated shampoos

    D11AC01 - Cetrimide

    API Reference Price

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    05-Jan-2021
    30-Oct-2024
    KGS
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