1. Also known as: Lauryl gallate, 1166-52-5, Dodecyl 3,4,5-trihydroxybenzoate, Nipagallin la, Progallin la, Gallic acid, dodecyl ester

Molecular Formula

C₁₉H₃₀O₅

Molecular Weight

338.4 g/mol

InChI Key

RPWFJAMTCNSJKK-UHFFFAOYSA-N

FDA UNII

45612DY463

dodecyl gallate is a natural product found in Alchornea glandulosa with data available.

1 2D Structure

2D Structure

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

dodecyl 3,4,5-trihydroxybenzoate

2.1.2 InChI

InChI=1S/C19H30O5/c1-2-3-4-5-6-7-8-9-10-11-12-24-19(23)15-13-16(20)18(22)17(21)14-15/h13-14,20-22H,2-12H2,1H3

2.1.3 InChI Key

RPWFJAMTCNSJKK-UHFFFAOYSA-N

2.1.4 Canonical SMILES

CCCCCCCCCCCCOC(=O)C1=CC(=C(C(=C1)O)O)O

2.2 Other Identifiers

2.2.1 UNII

45612DY463

2.3 Synonyms

2.3.1 MeSH Synonyms

1. Antioxidant E 312

2. Antioxidant E-312

3. E 312 Antioxidant

4. E-312 Antioxidant

5. Lauryl Gallate

2.3.2 Depositor-Supplied Synonyms

1. Lauryl Gallate

2. 1166-52-5

3. Dodecyl 3,4,5-trihydroxybenzoate

4. Nipagallin La

5. Progallin La

6. Gallic Acid, Dodecyl Ester

7. Gallic Acid, Lauryl Ester

8. Benzoic Acid, 3,4,5-trihydroxy-, Dodecyl Ester

9. N-dodecyl Gallate

10. N-dodecylgallate

11. Lauryl 3,4,5-trihydroxybenzoate

12. Dodecylester Kyseliny Gallove

13. Gallic Acid N-dodecyl Ester

14. Nsc 133463

15. Gallic Acid Lauryl Ester

16. Gallic Acid-dodecyl Ester

17. E312

18. Chembl16121

19. Lauryl Gallate(dodecyl Gallate)

20. 3,4,5-trihydroxybenzoic Acid, Dodecyl Ester

21. Mfcd00002195

22. Nsc133463

23. Nsc-133463

24. 45612dy463

25. Dsstox_cid_28164

26. Dsstox_rid_82725

27. Dsstox_gsid_48189

28. Gallic Acid Dodecyl Ester

29. Antioxidant E 312

30. Antioxidant E-312

31. E 312 Antioxidant

32. E-312 Antioxidant

33. Cas-1166-52-5

34. Ccris 5568

35. Einecs 214-620-6

36. Dodecylester Kyseliny Gallove [czech]

37. Brn 2701981

38. Dodecylgallat

39. Unii-45612dy463

40. Schembl36820

41. Gallic Acid, N-dodecyl Ester

42. 4-10-00-02006 (beilstein Handbook Reference)

43. Bidd:er0314

44. Lauryl 3,5-trihydroxybenzoate

45. Dodecyl Gallate [inci]

46. Ins No.312

47. Wln: Qr Bq Cq Evo12

48. Dodecyl Gallate [mart.]

49. Dtxsid0048189

50. Ins-312

51. Chebi:175304

52. Dodecyl-3,4,5-trihydroxybenzoate

53. Gallic Acid, Dodecyl Ester (8ci)

54. Bcp15874

55. Dodecyl Ester Of Gallic Acid

56. Tox21_202724

57. Tox21_303487

58. Bdbm50093887

59. S6229

60. Zinc33861415

61. Akos001482340

62. Dodecyl 3,4,5-tris(oxidanyl)benzoate

63. Dodecyl Gallate [ep Monograph]

64. Gs-3008

65. Ncgc00257297-01

66. Ncgc00260272-01

67. Sy048252

68. Db-108599

69. Hy-124082

70. 3,4,5-trihydroxy-benzoic Acid Dodecyl Ester

71. Benzoic Acid,4,5-trihydroxy-, Dodecyl Ester

72. Cs-0084125

73. E-312

74. Ft-0626593

75. G0015

76. Lauryl Gallate, Analytical Reference Material

77. D70249

78. Lauryl Gallate, Antioxidant, >=99.0% (hplc)

79. A803659

80. Q418209

81. 3,4,5-trihydroxybenzoic Acid Dodecyl Ester

82. W-108577

83. Dodecyl Gallate, European Pharmacopoeia (ep) Reference Standard

84. N-dodecyl (or Lauryl) Ester Of 3,4,5-trihydroxybenzoic Acid

85. 149030-04-6

2.4 Create Date

2005-03-26

3 Chemical and Physical Properties

Molecular Formula	C₁₉H₃₀O₅
Molecular Weight	338.4 g/mol
XLogP3	5.8
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	13
Exact Mass	338.20932405 g/mol
Monoisotopic Mass	338.20932405 g/mol
Topological Polar Surface Area	87 Å²
Heavy Atom Count	24
Formal Charge	0
Complexity	322
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	1

Technical details about MolPort-001-786-750, learn more about the structure, uses, toxicity, action, side effects and more

MolPort-001-786-750

Synopsis

Chemistry

PRICE INFORMATION

API Reference Price

ANALYTICAL SOLUTION(s)

1 EDQM Standards

MolPort-001-786-750