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Synopsis

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Chemistry

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Also known as: 13048-33-4, Hexamethylene diacrylate, Kayarad hdda, 1,6-hexamethylene diacrylate, Sartomer 238, Hdoda

Molecular Formula

C₁₂H₁₈O₄

Molecular Weight

226.27 g/mol

InChI Key

FIHBHSQYSYVZQE-UHFFFAOYSA-N

FDA UNII

FY751V5MMY

1 2D Structure

EM-221

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

6-prop-2-enoyloxyhexyl prop-2-enoate

2.1.2 InChI

InChI=1S/C12H18O4/c1-3-11(13)15-9-7-5-6-8-10-16-12(14)4-2/h3-4H,1-2,5-10H2

2.1.3 InChI Key

FIHBHSQYSYVZQE-UHFFFAOYSA-N

2.2 Other Identifiers

2.2.1 UNII

FY751V5MMY

2.3 Synonyms

2.3.1 MeSH Synonyms

1. Hexamethylene Diacrylate

2. Hexanediol Diacrylate

2.3.2 Depositor-Supplied Synonyms

1. 13048-33-4

2. Hexamethylene Diacrylate

3. Kayarad Hdda

4. 1,6-hexamethylene Diacrylate

5. Sartomer 238

6. Hdoda

7. Viscoat 230

8. Hexamethylene Acrylate

9. Photomer 4017

10. Hexamethylene Glycol Diacrylate

11. Setalux Uv 2243

12. Sartomer Sr 238

13. Hdda

14. Nk Ester A Hd

15. Acrylic Acid, Hexamethylene Ester

16. Hexaneglycol Diarcylate

17. 2-propenoic Acid, 1,6-hexanediyl Ester

18. Nk Ester A-hd

19. Sr 238

20. 1,6-hexanediol Di-2-propenoate

21. C 716

22. Fy751v5mmy

23. Dtxsid9025401

24. Laromer Hdda

25. Kayarad Ks-hdda

26. New Frontier Hdda

27. Actilane 425

28. Sartomer Sr-238

29. Photomer 4017f

30. 2-propenoic Acid, 1,1'-(1,6-hexanediyl) Ester

31. Hexamethyleneglycol Diacrylate

32. Genomer 1223

33. Hexaneglycol Diacrylate

34. Agisyn 2816

35. M-200 (acrylate)

36. Dtxcid705401

37. Em-221tf

38. Sr-238ns

39. 1,6-hexamethylenediol Diacrylate

40. Light Acrylate 1,6hx-a

41. Light Acrylate Sr-238f

42. 1,6hx-a

43. Sr-238f

44. 1,6-hexanediyl Diacrylate

45. Em-221

46. Sm-626

47. Sr-238

48. Sr-2389

49. M 200

50. V-230

51. Refchem:73627

52. 235-921-9

53. Hexanediol Diacrylate

54. Hexane-1,6-diyl Diacrylate

55. 6-prop-2-enoyloxyhexyl Prop-2-enoate

56. 1,6-bis(acryloyloxy)hexane

57. Mfcd00008631

58. Hexane-1,6-diyl Bisacrylate

59. Hexane-1,6-diyl Diacrylate (stabilized With Mehq)

60. Cas-13048-33-4

61. Hexanediol Diacrylate(9 Cp(25 Degrees C))

62. Ccris 4823

63. Hexamethylenediacrylate

64. Hsdb 6109

65. Einecs 235-921-9

66. Unii-fy751v5mmy

67. Brn 1870540

68. 1,6-hexanediol Diacrylate (stabilized With 100 Ppm Mehq) (>85%)

69. Ks-hdda

70. Nk Ester A-hd-n

71. 1,6-hexandiol Diacrylate

72. 1,6 Hexanediol Diacrylate

73. Hexamethylenediol Diacrylate

74. A-hd-n

75. Ec 235-921-9

76. C-6da

77. Schembl33725

78. 1,6-bis(acryloyloxy)hexane (stabilized With Mehq)

79. 1,6-hexanediol Diacrylate (stabilized With Mehq)

80. Light Ester 1.6hx-a

81. Chembl1530684

82. 6-(acryloyloxy)hexyl Acrylate #

83. 1,6-hexanediol Diacrylate, 90%

84. 1.6hx

85. Hexanediol Diacrylate (hdda)

86. Tox21_201349

87. Tox21_303168

88. Msk161342

89. Akos015904309

90. Hexamethylene Diacrylate, 1,6-

91. Ncgc00091257-01

92. Ncgc00091257-02

93. Ncgc00091257-03

94. Ncgc00091257-04

95. Ncgc00257183-01

96. Ncgc00258901-01

97. 1,6-hexanediol Diacrylate [hsdb]

98. As-75465

99. Db-254921

100. B2936

101. Cs-0158045

102. Ns00007428

103. 1,6-hexanediol Diacrylate, Technical Grade, 80%

104. F242822

105. 1,6-bis(acryloyloxy)hexane, (stabilized With Mehq)

106. Q1276266

107. 1,6-hexamethylene Diacrylate (1,6-hexanediol Diacrylate), Visc.5-8 Cps

2.4 Create Date

2005-03-27

3 Chemical and Physical Properties

Molecular Formula	C₁₂H₁₈O₄
Molecular Weight	226.27 g/mol
XLogP3	2.6
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	11
Exact Mass	Da
Monoisotopic Mass	Da
Topological Polar Surface Area	52.6
Heavy Atom Count	16
Formal Charge	0
Complexity	219
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

4 Pharmacology and Biochemistry

4.1 Metabolism/Metabolites

Acrylates and methacrylates are detoxified predominantly via conjugation with glutathione via the Michael addition reaction or glutathione-S-transferase. They are also likely to be hydrolyzed via carboxylesterases. The lower molecular weight esters are rapidly metabolized and eliminated, therefore, will not likely cause cumulative toxicity. /Acrylates/

Bingham, E.; Cohrssen, B.; Powell, C.H.; Patty's Toxicology Volumes 1-9 5th ed. John Wiley & Sons. New York, N.Y. (2001)., p. V6 600

4.2 Mechanism of Action

...Dimethacrylates proved to be moderate to strong sensitizers in the guinea pig.

PMID:6839734 Van Der Walle HB et al; Contact Dermatitis 9(1): 10-20 (1983)

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