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Chemical Structure| 1169768-13-1 Chemical Structure| 1169768-13-1

Structure of 1169768-13-1

Chemical Structure| 1169768-13-1

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Product Details of [ 1169768-13-1 ]

CAS No. :1169768-13-1
Formula : C43H79N3O4
M.W : 702.11
SMILES Code : C(OC(NCCCCCCCC/C=C\C/C=C\CCCCC)=O)(COC(NCCCCCCCC/C=C\C/C=C\CCCCC)=O)CN(C)C
MDL No. :N/A

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Application In Synthesis of [ 1169768-13-1 ]

* All experimental methods are cited from the reference, please refer to the original source for details. We do not guarantee the accuracy of the content in the reference.

  • Downstream synthetic route of [ 1169768-13-1 ]

[ 1169768-13-1 ] Synthesis Path-Downstream   1~1

  • 1
  • [ 623-57-4 ]
  • linoleyl isocyanate [ No CAS ]
  • [ 1169768-13-1 ]
YieldReaction ConditionsOperation in experiment
2.2 g In benzene; at 20℃; for 5h;Inert atmosphere; Reflux; [0255] To a solution of the above crude linoleyl isocyanate (7.6 g, ca. 25 mmol) in 150 mL of anhydrous benzeneunder nitrogen was added dropwise a solution of <strong>[623-57-4]3-(dimethylamino)-1,2-propanediol</strong> (0.99 g, 8.3 mmol) in 20 mL ofanhydrous benzene. The resulting mixture was stirred at room temperature for 60 min and then refluxed for 4 hoursfollowed by stirring at room temperature overnight. Upon dilution of the mixture with 150 mL benzene, the organic phasewas washed with water (3 x100 mL), brine (100 mL), and dried over anhydrous Na2SO4. Evaporation of the solventgave 8.4 g of yellow oil. Column purification of the oily material (500 mL silica gel, 230-400 mesh, eluted with 0-3percentmethanol gradient in chloroform) afforded 2.2 g (38percent) of yellowish oil as the product DLin-C-DAP. 1 H NMR (400 MHz,CDCl3) delta: 5.37 (8H, m, 4 x CH=CH), 5.06 (1 H, br. CONH), 4.91 (1 H, br. CONH), 4.79 (1 H, m, OCH), 4.28 (1 H, br. d,J = 11 Hz, OCH), 4.16 (1 H, dd, J = 12 and 6 Hz, OCH), 3.16 (4H, m, 2 x NCH2), 2.77 (4H, t, J = 6.4 Hz, =CH-CH2-CH=),2.4-2.7 (2H, m, NCH2), 2.33 (6H, s, 2 x NCH3), 2.05 (8H, m, allylic 4 x CH2), 1.4-1.55 (4H, m, 2 x CH2), 1.29 (40H, s,20 x CH2), 0.89 (6H, t, 2 x CH3) ppm.
 

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