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    Cetyl Trimethyl Ammonium Chloride

    ACTIVE PHARMA INGREDIENTS

    PharmaCompass
    $ API Ref.Price (USD/KG) : 1Xls

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    2D Structure
    Also known as: 112-02-7, Cetyltrimethylammonium chloride, Cetrimonium chloride, N,n,n-trimethylhexadecan-1-aminium chloride, N-hexadecyltrimethylammonium chloride, Cetyl trimethyl ammonium chloride
    Molecular Formula
    C19H42ClN
    Molecular Weight
    320.0  g/mol
    InChI Key
    WOWHHFRSBJGXCM-UHFFFAOYSA-M
    FDA UNII
    UC9PE95IBP
    Cetyltrimethylammonium compound whose salts and derivatives are used primarily as topical antiseptics.
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    hexadecyl(trimethyl)azanium;chloride
    2.1.2 InChI
    InChI=1S/C19H42N.ClH/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(2,3)4;/h5-19H2,1-4H3;1H/q+1;/p-1
    2.1.3 InChI Key
    WOWHHFRSBJGXCM-UHFFFAOYSA-M
    2.1.4 Canonical SMILES
    CCCCCCCCCCCCCCCC[N+](C)(C)C.[Cl-]
    2.2 Other Identifiers
    2.2.1 UNII
    UC9PE95IBP
    2.3 Synonyms
    2.3.1 MeSH Synonyms

    1. 1-hexadecyltrimethylammonium Chloride

    2. Cetavlon

    3. Cetrimide

    4. Cetriminium

    5. Cetrimonium

    6. Cetrimonium Bromide

    7. Cetrimonium Chloride

    8. Cetrimonium Hydroxide

    9. Cetrimonium Iodide

    10. Cetrimonium Methosulfate

    11. Cetrimonium Methyl Sulfate

    12. Cetrimonium Monosulfate

    13. Cetyltrimethylammonium Bromide

    14. Cetyltrimethylammonium Chloride

    15. Ctab

    16. Ctaoh

    17. Hexadecyl Trimethyl Ammonium Bromide

    18. Hexadecyl(trimethyl)azanium

    19. Hexadecyltrimethylammonium Bromide

    20. Hexadecyltrimethylammonium Octylsulfonate

    21. Htab Cpd

    22. Octylsulfonate, Hexadecyltrimethylammonium

    2.3.2 Depositor-Supplied Synonyms

    1. 112-02-7

    2. Cetyltrimethylammonium Chloride

    3. Cetrimonium Chloride

    4. N,n,n-trimethylhexadecan-1-aminium Chloride

    5. N-hexadecyltrimethylammonium Chloride

    6. Cetyl Trimethyl Ammonium Chloride

    7. Hexadecyl Trimethyl Ammonium Chloride

    8. Trimethylhexadecylammonium Chloride

    9. Genamin Ctac

    10. Trimethylcetylammonium Chloride

    11. Arquad 16-50

    12. Cetac

    13. Ctac

    14. Htac

    15. Palmityltrimethylammonium Chloride

    16. Arquad 16-29

    17. 1-hexadecanaminium, N,n,n-trimethyl-, Chloride

    18. Hexadecyl(trimethyl)azanium;chloride

    19. N,n,n-trimethyl-1-hexadecanaminium Chloride

    20. Hexadecyl(trimethyl)ammonium Chloride

    21. Cetyltrimethyl Ammonium Chloride

    22. Chebi:53581

    23. Uc9pe95ibp

    24. C14-18-alkyltrimethyl Ammonium Chlorides

    25. 68002-63-1

    26. Cetyl(trimethyl)ammonium Chloride

    27. Dehyquart A

    28. Trimethyl-1-hexadecanaminium Chloride

    29. Aliquat 6

    30. Quaternary Ammonium Compounds, C14-18-alkyltrimethyl, Chlorides

    31. Adogen 444

    32. Surfroyal Ctac

    33. Dehyquart A-ca

    34. Morpan Cha

    35. Quartamin 60w

    36. Ammonyx Cetac 30

    37. Arquad 16

    38. Intexsan Ctc 29

    39. Intexsan Ctc 50

    40. Barquat Ct 29

    41. Intexan Ctc 29

    42. Variquat E 228

    43. Carsoquat Ct 429

    44. Cation Pb 40

    45. Hdtma-cl

    46. Catinal Ctc 70et

    47. Dodigen 1383

    48. Lebon Tm 16

    49. Lebon Tm 60

    50. Caswell No. 167a

    51. Pionin B 611

    52. Nissan Cation Pb 40

    53. Arquad 16-25lo

    54. Swanol Ca 2350

    55. Arquad 16-25w

    56. Arquad 16-29w

    57. Arquad 16-26

    58. Arquad 16/28

    59. Quatramine C 16/29

    60. Fsm 28

    61. Hsdb 5553

    62. Pb 40

    63. Einecs 203-928-6

    64. Unii-uc9pe95ibp

    65. Mfcd00011773

    66. Epa Pesticide Chemical Code 069133

    67. Surfaktivo (tn)

    68. Hexadecyl(trimethyl)azanium Chloride

    69. Einecs 268-077-5

    70. Ammonium, Hexadecyltrimethyl-, Chloride

    71. (c14-c18)alkyltrimethylammonium Chloride

    72. Dsstox_cid_6901

    73. Jeequat Ct-29

    74. Epitope Id:116882

    75. Varisoft 300

    76. Ec 203-928-6

    77. Cetrimonium Chloride (ban)

    78. Dsstox_rid_78243

    79. Dsstox_gsid_26901

    80. Schembl24536

    81. Nikkol Ca-2350

    82. Arquad Pc 16-29w

    83. Cetyl Trimethylammonium Chloride

    84. Cetyltrimethyl-ammonium Chloride

    85. 1-hexadecanaminium, N,n,n-trimethyl-, Chloride (1:1)

    86. Chembl1895807

    87. Dtxsid6026901

    88. Cetrimonium Chloride [ii]

    89. Cetrimonium Chloride [inci]

    90. Hexadecyltrimethyl Ammonium Chloride

    91. Amy33367

    92. Tox21_202555

    93. Cetrimonium Chloride [mart.]

    94. Cetrimonium Chloride [who-dd]

    95. Akos015899168

    96. Akos015960532

    97. (1-hexadecyl)trimethylammonium Chloride

    98. Cs-w012007

    99. Fs-4302

    100. Ncgc00164283-02

    101. Ncgc00260104-01

    102. Cas-112-02-7

    103. N,n,n-trimethylhexadecan-1-aminiumchloride

    104. Db-025307

    105. Ft-0631635

    106. H0082

    107. (1-hexadecyl)trimethylammonium Chloride, 96%

    108. D07672

    109. Trimethylhexadecylammonium Chloride [hsdb]

    110. A802470

    111. Q1061007

    112. Tetrahydro-4-methyl-2-(2-methyl-1-propen-1-yl)-

    113. W-108660

    2.4 Create Date
    2005-07-19
    3 Chemical and Physical Properties
    Molecular Weight 320.0 g/mol
    Molecular Formula C19H42ClN
    Hydrogen Bond Donor Count0
    Hydrogen Bond Acceptor Count1
    Rotatable Bond Count15
    Exact Mass319.3005780 g/mol
    Monoisotopic Mass319.3005780 g/mol
    Topological Polar Surface Area0 Ų
    Heavy Atom Count21
    Formal Charge0
    Complexity181
    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

    Anti-Infective Agents, Local

    Substances used on humans and other animals that destroy harmful microorganisms or inhibit their activity. They are distinguished from DISINFECTANTS, which are used on inanimate objects. (See all compounds classified as Anti-Infective Agents, Local.)