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Chemical Structure| 70243-51-5 Chemical Structure| 70243-51-5

Structure of 70243-51-5

Chemical Structure| 70243-51-5

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Product Details of [ 70243-51-5 ]

CAS No. :70243-51-5
Formula : C15H21NO
M.W : 231.33
SMILES Code : O[C@H]1C[C@@](CCC[C@@]2([H])C1)(N2CC3=CC=CC=C3)[H]
MDL No. :MFCD00209918
InChI Key :DNAGSRDCXSVFLX-YIONKMFJSA-N
Pubchem ID :14403180

Safety of [ 70243-51-5 ]

GHS Pictogram:
Signal Word:Danger
Hazard Statements:H314-H302
Precautionary Statements:P301+P330+P331-P301+P312-P280-P310-P305+P351+P338
Class:8
UN#:1759
Packing Group:

Application In Synthesis of [ 70243-51-5 ]

* 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 [ 70243-51-5 ]

[ 70243-51-5 ] Synthesis Path-Downstream   1~2

  • 1
  • [ 70243-51-5 ]
  • [ 504-12-1 ]
YieldReaction ConditionsOperation in experiment
With hydrogenchloride; hydrogen;palladium 10% on activated carbon; In ethanol; water; at 40℃; for 48.0h; 10% Palladium on carbon (10% Pd/C) (5.0 g) was added to a solution of enαto-9-benzyl-9- azabicyclo[3.3.1]nonan-3-ol (27.0 g, 0.12 mol) in ethanol (500 ml.) and 5N aqueous hydrochloric acid (25 ml_). The mixture was stirred under a hydrogen atmosphere (3 bar) at 40 0C for 48 h. The mixture was then filtered through a pad of dicalite and the filtrate was evaporated in vacuo and remaining aqueous mixture azeotroped with toluene (2 x150 ml.) to yield crude endo-9-azabicyclo[3.3.1]nonan-3-ol as a pale yellow solid which was used directly in the next stage.
With hydrogen;palladium 10% on activated carbon; In ethanol; water; at 40℃; under 2250.23 Torr; for 48.0h; 10% Palladium on carbon (10% Pd/C) (5.0 g) was added to a solution of endo-9-benzyl-9-azabicyclo[3.3.1]nonan-3-ol (27.0 g, 0.12 mol) in ethanol (500 mL) and 5N aqueous hydrochloric acid (25 mL). The mixture was stirred under a hydrogen atmosphere (3 bar) at 40 C. for 48 h.The mixture was then filtered through a pad of dicalite and the filtrate was evaporated in vacuo and remaining aqueous mixture azeotroped with toluene (2 150 mL) to yield crude endo-9-azabicyclo[3.3.1]nonan-3-ol as a pale yellow solid which was used directly in the next stage.
  • 2
  • [ 70243-51-5 ]
  • [ 107-30-2 ]
  • [ 141483-15-0 ]
  • 3-endo-(2-methoxymethoxy-4-(trifluoromethyl)phenoxy)-9-benzyl-9-azabicyclo[3.3.1]nonane [ No CAS ]
YieldReaction ConditionsOperation in experiment
6.27 g 3-endo-hydroxy-9-benzyl-9-azabicyclo [3.3.1] nonane (compound (10)) was synthesized by the method described in WO 2007/039563.To a solution of 2.83 g of 2-fluoro-5- (trifluoromethyl) phenol in 20 ml of N, N-dimethylformamide, 0.75 g of 60% sodium hydride was added under ice cooling.The mixture was stirred at room temperature for 30 minutes.Thereafter, 1.39 g of chloromethyl methyl ether was added dropwise under cooling with ice.The mixture was heated to room temperature, stirred for 30 minutes, then heated to 80 C. and stirred for 1 hour.To the mixture were added 4 g of the compound (10) and 0.94 g of 60% sodium hydride, and the mixture was stirred for 3 hours.The mixture was cooled to room temperature, poured into water and then extracted with ethyl acetate.The organic phase was washed with water, dried over anhydrous magnesium sulfate, filtered, and concentrated under reduced pressure.The residue was purified by column chromatography to obtain 6.27 g of compound (11).
 

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