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Laurtrimonium Bromide

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ACTIVE PHARMA INGREDIENTS

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Synopsis

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Chemistry

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Also known as: 1119-94-4, Dtab, Dctab, Dodecyl trimethyl ammonium bromide, Laurtrimonium bromide, Ltab

Molecular Formula

C₁₅H₃₄BrN

Molecular Weight

308.34 g/mol

InChI Key

XJWSAJYUBXQQDR-UHFFFAOYSA-M

FDA UNII

6IC8NZ97S2

1 2D Structure

Laurtrimonium Bromide

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

dodecyl(trimethyl)azanium;bromide

2.1.2 InChI

InChI=1S/C15H34N.BrH/c1-5-6-7-8-9-10-11-12-13-14-15-16(2,3)4;/h5-15H2,1-4H3;1H/q+1;/p-1

2.1.3 InChI Key

XJWSAJYUBXQQDR-UHFFFAOYSA-M

2.1.4 Canonical SMILES

CCCCCCCCCCCC[N+](C)(C)C.[Br-]

2.2 Other Identifiers

2.2.1 UNII

6IC8NZ97S2

2.3 Synonyms

2.3.1 MeSH Synonyms

1. 1-dodecanaminium, N,n,n-trimethyl-, Bromide

2. Ammonium, Dodecyltrimethyl-, Chloride

3. Ammonium, Dodecyltrimethyl-,bromide

4. C(12)tac

5. C12qac

6. C12tac

7. Dodecyl Trimethyl Ammonium Chloride

8. Dodecyl Trimethylammonium Chloride

9. Dodecyltrimethylammonium

10. Dodecyltrimethylammonium Chloride

11. Dodecyltrimethylammonium Chromate (2:1)

12. Dodecyltrimethylammonium Ethyl Sulfate

13. Dodecyltrimethylammonium Hydroxide

14. Dodecyltrimethylammonium Iodide

15. Dodecyltrimethylammonium Maleate (2:1)

16. Dodecyltrimethylammonium Methyl Sulfate Salt

17. Dodecyltrimethylammonium Perchlorate

18. Dodecyltrimethylammonium Sulfate (2:1)

19. Dodecyltrimethylammonium Sulfide (2:1)

20. Dodecyltrimethylammonium Thiomolybdate Salt Hydrate

21. Dotac Compound

22. Dtmacl Cpd

23. Laurtrimonium

24. Laurtrimonium Bromide

25. Laurtrimonium Chloride

26. Lauryl Trimethyl Ammonium Chloride

27. Lauryltrimethylammonium Bromide

28. Lauryltrimethylammonium Chloride

29. Monolauryltrimethylammonium Chloride

30. N,n,n-trimethyl-1-dodecanaminium Chloride

31. N-dodecyl Triethylammonium Bromide

32. N-dodecyltrimethylammonium

33. N-dodecyltrimethylammonium Chloride

2.3.2 Depositor-Supplied Synonyms

1. 1119-94-4

2. Dtab

3. Dctab

4. Dodecyl Trimethyl Ammonium Bromide

5. Laurtrimonium Bromide

6. Ltab

7. Lauryltrimethylammonium Bromide

8. N,n,n-trimethyldodecan-1-aminium Bromide

9. Morpan D

10. 1-dodecanaminium, N,n,n-trimethyl-, Bromide

11. Dtab (surfactant)

12. Trimethyllaurylammonium Bromide

13. Trimethyldodecylammonium Bromide

14. Fsm 23

15. Dodecyl(trimethyl)azanium;bromide

16. N-lauryl-n,n,n-trimethylammonium Bromide

17. N,n,n-trimethyldodecan-1-ammonium Bromide

18. Einecs 214-290-3

19. Unii-6ic8nz97s2

20. N,n,n-trimethyl-1-dodecanaminiuim Bromide

21. Lauryltrimethylaminium Bromide

22. 6ic8nz97s2

23. Lauryl Trimethyl Ammonium Bromide

24. Chebi:282662

25. Dodecyltrimethylammonium (bromide)

26. Lauryltrimethylammonium Bromide;ddtma

27. (1-dodecyl)trimethylammonium Bromide

28. 1-dodecanaminium, N,n,n-trimethyl-, Bromide (1:1)

29. Chembl109873

30. Dodecyltrimethylammoniumbromide

31. N-dodecyl Trimethylammonium Bromide

32. Ai3-14973

33. Ammonium, Dodecyltrimethyl-, Bromide

34. Dodecyl(trimethyl)azanium Bromide

35. Dodecyl(trimethyl)ammonium Bromide

36. Ddtmabr

37. Mfcd00011767

38. Ddtma

39. Dsstox_cid_24366

40. Dsstox_rid_80174

41. Dsstox_gsid_44366

42. Schembl56981

43. Dodecyltrimethyl Ammonium Bromide

44. Dtxsid5044366

45. Dodecyl-trimethyl-ammonium Bromide

46. Ammonium, Dodecyltrimethyl-,bromide

47. Hy-d0838

48. Laurtrimonium Bromide [inci]

49. Tox21_302084

50. Akos015914882

51. Jc10040

52. Ncgc00255995-01

53. As-12886

54. 1-dodecanaminium,n,n,n-trimethyl-,bromide

55. Cas-1119-94-4

56. Db-050359

57. Cs-0014808

58. D1468

59. Ft-0604994

60. C20389

61. N,n,n-trimethyl-1-dodecanaminium Bromide

62. A802463

63. W-108662

64. Q27225722

2.4 Create Date

2005-07-19

3 Chemical and Physical Properties

Molecular Formula	C₁₅H₃₄BrN
Molecular Weight	308.34 g/mol
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	11
Exact Mass	307.18746 g/mol
Monoisotopic Mass	307.18746 g/mol
Topological Polar Surface Area	0 Å²
Heavy Atom Count	17
Formal Charge	0
Complexity	135
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	2

4 Pharmacology and Biochemistry

4.1 MeSH Pharmacological Classification

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.)

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.)

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