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Chemical Structure| 5350-41-4 Chemical Structure| 5350-41-4

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Chemical Structure| 5350-41-4

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Product Details of [ 5350-41-4 ]

CAS No. :5350-41-4
Formula : C10H16BrN
M.W : 230.15
SMILES Code : C[N+](C)(C)CC1=CC=CC=C1.[Br-]
MDL No. :MFCD00011780
InChI Key :UUZYBYIOAZTMGC-UHFFFAOYSA-M
Pubchem ID :21449

Safety of [ 5350-41-4 ]

GHS Pictogram:
Signal Word:Warning
Hazard Statements:H315-H319-H335
Precautionary Statements:P261-P305+P351+P338

Application In Synthesis of [ 5350-41-4 ]

* 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 [ 5350-41-4 ]

[ 5350-41-4 ] Synthesis Path-Downstream   1~35

  • 1
  • [ 100-39-0 ]
  • [ 75-50-3 ]
  • [ 5350-41-4 ]
YieldReaction ConditionsOperation in experiment
98% In tetrahydrofuran; ethanol; at 25℃; for 24h;Inert atmosphere; General procedure: In analogy to literature4, to a solution of benzyl halide 9 (1 equiv.) in THF (50 ml/g benzyl halide) were added 1.5 equiv. of trimethylamine 10 (33 wtpercent in EtOH).The resulting solution was stirred at RT for 24 hours, during which the product precipitated asa white solid. The resulting suspension was cooled to 0 °C, filtrated, washed with ice-cold Et2O and dried in vacuo to yield benzyl ammonium salts 6 in the reported yields.
90% In ethanol; acetonitrile; In ethanol30percent triethylamine (0.76 ml, 3.1 mmol)Was dissolved in acetonitrile (5 ml)Was treated with benzyl bromide (0.40 ml, 3.4 mmol).The residue was dissolved in chloroform,Purification by precipitation in ether gave 1 (0.693 g, 90percent) as a white powder.
  • 2
  • [ 5350-41-4 ]
  • [ 1520-42-9 ]
  • 3
  • [ 60-29-7 ]
  • [ 5350-41-4 ]
  • [ 591-51-5 ]
  • [ 1520-42-9 ]
  • [ 2449-49-2 ]
  • [ 75-50-3 ]
  • 4
  • [ 5350-41-4 ]
  • [ 591-51-5 ]
  • [ 1520-42-9 ]
  • [ 2449-49-2 ]
  • 5
  • [ 5350-41-4 ]
  • [ 100-46-9 ]
  • [ 103-49-1 ]
  • 6
  • [ 5350-41-4 ]
  • [ 100-46-9 ]
  • [ 103-49-1 ]
  • [ 75-50-3 ]
  • 8
  • [ 67-56-1 ]
  • [ 5350-41-4 ]
  • [ 538-86-3 ]
  • [ 6912-12-5 ]
  • [ 103-29-7 ]
  • [ 108-88-3 ]
  • 9
  • [ 67-56-1 ]
  • [ 5350-41-4 ]
  • [ 2840-24-6 ]
  • [ 103-29-7 ]
  • [ 108-88-3 ]
  • [ 100-51-6 ]
  • 10
  • [ 67-56-1 ]
  • [ 5350-41-4 ]
  • [ 538-86-3 ]
  • [ 100-51-6 ]
  • 12
  • [ 5350-41-4 ]
  • [ 6427-70-9 ]
  • 13
  • [ 5350-41-4 ]
  • [ 2840-24-6 ]
  • [ 103-29-7 ]
  • [ 108-88-3 ]
  • [ 100-51-6 ]
  • 14
  • [ 5350-41-4 ]
  • benzyltrimethylammonium bromite [ No CAS ]
  • 15
  • [ 5350-41-4 ]
  • Trimethyl-(4-sulfo-benzyl)-ammonium; hydrogen sulfate [ No CAS ]
  • Trimethyl-(3-sulfo-benzyl)-ammonium; hydrogen sulfate [ No CAS ]
  • Trimethyl-(2-sulfo-benzyl)-ammonium; hydrogen sulfate [ No CAS ]
  • 16
  • [ 5350-41-4 ]
  • (3,5-Disulfo-benzyl)-trimethyl-ammonium; hydrogen sulfate [ No CAS ]
  • (2,4-Disulfo-benzyl)-trimethyl-ammonium; hydrogen sulfate [ No CAS ]
  • 17
  • [ 5350-41-4 ]
  • C10H15N [ No CAS ]
  • 20
  • [ 5350-41-4 ]
  • [ 75-65-0 ]
  • [ 3459-80-1 ]
  • [ 103-29-7 ]
  • [ 108-88-3 ]
  • [ 100-51-6 ]
  • 21
  • [ 5350-41-4 ]
  • 2C10H16N(1+)*Br6Se4(2-) [ No CAS ]
  • 23
  • [ 5350-41-4 ]
  • [ 111-46-6 ]
  • sodium sulfide hydrate [ No CAS ]
  • [ 538-74-9 ]
  • [ 75-50-3 ]
  • 24
  • [ 5350-41-4 ]
  • thallium(I) (E)-methanediazotate [ No CAS ]
  • [ 113925-82-9 ]
  • 25
  • [ 103-83-3 ]
  • [ 74-83-9 ]
  • [ 5350-41-4 ]
  • 26
  • [ 3459-92-5 ]
  • [ 2840-24-6 ]
  • [ 5350-41-4 ]
  • 27
  • [ 5350-41-4 ]
  • benzyltrimethylazanium tribroman-2-uide [ No CAS ]
YieldReaction ConditionsOperation in experiment
89% With 3-chloro-benzenecarboperoxoic acid; potassium bromide; In water; for 0.1h; 6. Synthesis of Benzyltrimethylammonium tribromides, BTMATB: 1 equiv of benzyltrimethylammonium bromide (1 mmol, 0.120 g), 2 equiv of KBr (2 mmol, 0.238 g) and 2 equiv of MCPBA (2mmol, 0.346 g) were mixed together in 10 mL of water and stirred for ca. 6 min. The orange colouredproduct formed was washed with NaHCO3 solution (10 percent solution) for several times to remove unreactedsubstrate. After that the crude product was again washed with water to remove by-products. Thecompound was dried in vacuo and recrystallized with EtOAc; mp: 99oC. Yield: 0.346 g; 89 percent.
82.04% With sulfuric acid; dihydrogen peroxide; potassium bromide;molybdic acid; In water; at 0 - 20℃; for 0.916667h; Molybdic acid monohydrate, H2MOO4. H20 (0.13mmol, 0.023g), potassium bromide, KBr (26. 06MMOL, 3.1g) and benzyltrimethylammonium bromide, BTMAB (13.03mmol, 3. 0g) were powdered separately, mixed together smoothly and thoroughly. The whole was transferred to a boat kept on ice-water bath and 30percent hydrogen peroxide, H202 (13. 23MMOL, 1. 5ML) was added drop wise with continuous grinding for 15 min, followed by drop wise addition of 10M H2SO4 (13. 0MMOL, 1. 3mL) leading to the formation of a yellow colored solution. It was stirred smoothly with glass rod for 10 min and then at room temperature for 30MIN. An exothermic reaction set in to form orange-yellow crystalline compound of <strong>[5350-41-4]benzyltrimethylammonium tribromide</strong>, BTMATB. The compound was dried over fused CaCl2 and extracted with ethyl acetate by dissolving in minimum amount of solvent followed by filtration through Whatman No. 42 filter paper. Aqueous phase, if present, could be separated using anhydrous sodium sulphate. The organic layer was concentrated to get yellow-orange <strong>[5350-41-4]benzyltrimethylammonium tribromide</strong>, BTMATB. Yield: 4.17g (82. 04percent) Mp: 98-101°C. The chemical analyses, IR and conductance of the compound match very well with those reported in literature. Analytical data: The compound analyzed correctly COH, NBR3 : Calc. C, 30.8 ; H, 4.14 ; N, 3.59 ; Br, 61.47percent. Found. C, 30.7 ; H, 4.18 ; N, 3.62 ; Br, 61.53 percent.
82% With sodium hypochlorite; sulfuric acid; potassium bromide; for 0.166667h;Green chemistry; A solution of 2.4 g (20 mmol) of KBr in 10 mL of 4N H2SO4 was added to 2.3 g (10 mmol) of benzyltrimethylammonium bromide. To the resulting solution was added 10 mL of 4 percent sodium hypochlorite. The solution was stirred for ca. 10 mins and then the bright orange-yellow colored crystalline benzytrimethylammonium tribromide, BTMATB which had separated out was isolated by suction filtration and washed with water (5 mL) three to four times and dried under vacuum over anhydrous CaCl2 to give 3.19 g of BTMATB as orange crystals(yield 82percent). Mp: 99 C.
82% With periodic acid; potassium bromide; In neat (no solvent); at 20℃; General procedure: 1 equiv of tetraalkylammonium bromide (10 mmol), 2 equiv of KBr (20 mmol, 2.38 g)and 2 equiv of H5IO6 (20 mmol, 4.56 g) were mixed together and ground well in a mortar ca. 5-15 minutes. The orange coloured product formed was washed with water for several times to remove by-products. After that the crude product was extracted with ethyl acetate and the organic solvent was dried in vacuo to get pure product. Yield: 82-93 percent (0.3-0.4 g).

  • 28
  • [ 5350-41-4 ]
  • benzyltrimethylammonium tribromide [ No CAS ]
YieldReaction ConditionsOperation in experiment
82.04% With sulfuric acid; dihydrogen peroxide; potassium bromide;molybdic acid; In water; at 0 - 20℃; for 0.916667h;Product distribution / selectivity; Molybdic acid monohydrate, H2MoO4.H2O (0.13 mmol, 0.023 g), potassium bromide, KBr (26.06 mmol, 3.1 g) and benzyltrimethylammonium bromide, BTMAB (13.03 mmol, 3.0 g) were powdered separately, mixed together smoothly and thoroughly. The whole was transferred to a boat kept on ice-water bath and 30percent hydrogen peroxide, H2O2 (13.23 mmol, 1.5 mL) was added drop wise with continuous grinding for 15 min, followed by drop wise addition of 10M H2SO4 (13.0 mmol, 1.3 mL) leading to the formation of a yellow colored solution. It was stirred smoothly with glass rod for 10 min and then at room temperature for 30 min. An exothermic reaction set in to form orange-yellow crystalline compound of <strong>[5350-41-4]benzyltrimethylammonium tribromide</strong>, BTMATB. The compound was dried over fused CaCl2 and extracted with ethyl acetate by dissolving in minimum amount of solvent followed by filtration through Whatman No. 42 filter paper. Aqueous phase, if present, could be separated using anhydrous sodium sulphate. The organic layer was concentrated to get yellow-orange <strong>[5350-41-4]benzyltrimethylammonium tribromide</strong>, BTMATB. Yield: 4.17 g (82.04percent) Mp: 98-101° C. The chemical analyses, IR and conductance of the compound match very well with those reported in literature.Analytical data: The compound analyzed correctly C10H16NBr3: Calc. C, 30.8; H, 4.14; N, 3.59; Br, 61.47percent. Found. C, 30.7; H, 4.18; N, 3.62; Br, 61.53percent.
  • 29
  • [ 119-64-2 ]
  • [ 5350-41-4 ]
  • [ 6134-56-1 ]
YieldReaction ConditionsOperation in experiment
48.1% With acetic acid;Zinc chloride; In (2S)-N-methyl-1-phenylpropan-2-amine hydrate; water; EXAMPLE II-18 (Synthesis of Ex. Comp. No. (II-15)) In a 5 liter-three necked flask, 169.5 g (1.28 M) of 1,2,3,4-tetrahydronaphthalene and 3 liters of acetic acid were placed and stirred at room temperature. Under stirring, to the mixture, 650 g (1.67 M) of benzyltrimethylammonium bromide and 244.8 g (1.80 M) of zinc chloride were successively added, followed by stirring for 5.5 hours at 70° C. After the reaction, the reaction mixture was cooled to room temperature and poured into 3 liters of ice water, followed by extraction with methyl t-butyl ether. The organic layer was successively washed with 5percent-NaHSO3 aqueous solution, 5percent-NaOH aqueous solution and distilled water, followed by distilling-off of the solvent under reduced pressure to obtain 243.2 g of a dark brown liquid. The liquid was subjected to vacuum distillation (distillation under reduced pressure) (boiling point=108-110° C. at 667 Pa) to obtain 130.2 g of 6-bromo-1,2,3,4-tetrahydronaphthalene (Yield: 48.1percent).
  • 30
  • [ 31603-77-7 ]
  • [ 5350-41-4 ]
  • [ 96-79-7 ]
  • [ 91257-05-5 ]
YieldReaction ConditionsOperation in experiment
With sodium hydroxide; In dichloromethane; EXAMPLE 3 The mixture of 50 parts of alpha-(4-biphenylyl)acetonitrile, 45.8 parts of 2-chloro-N,N-diisopropylethylamine, 80 parts by volume of 50percent sodium hydroxide, 250 parts by volume of methylene chloride and 1 part of benzyltrimethylammonium bromide is stirred at room temperature with slight cooling in an icy water bath for about 24 hours. The mixture is then poured into water and to this mixture additional quantity of methylene chloride is added. The organic layer is separated, washed with water, dried over anhydrous sodium sulfate and concentrated to afford alpha-(4-biphenylyl)-alpha-[2-(diisopropylamino)ethyl]acetonitrile, as a solid. This compound is identical to that of Example 1.
  • 31
  • sodium(7,7,7-tricarbonyldodecahydro-7-cobalta-nido-undecaborate) [ No CAS ]
  • [ 5350-41-4 ]
  • [ 127738-45-8 ]
  • 32
  • [ 98938-44-4 ]
  • [ 5350-41-4 ]
  • {N(CH2Ph)Me3}{5,6,9,10-μ4-tricyclohexylphosphineaurio-nido-dodecahydrodecaborate} [ No CAS ]
  • 33
  • potassium{nido-7,8-C2B9H12} [ No CAS ]
  • [ 5350-41-4 ]
  • {NMe3(CH2Ph)}{dodecahydro-7,8-dicarba-nido-undecaborate} [ No CAS ]
  • 34
  • K(7,8-diphenyl-7,8-dicarba-nido-decahydroundecaborate(1-)) [ No CAS ]
  • [ 5350-41-4 ]
  • benzyltrimethylammonium 7,8-diphenyl-7,8-dicarba-nido-decahydroundecaborate(1-) [ No CAS ]
  • 35
  • tallium ocatahydrotriborate [ No CAS ]
  • [ 5350-41-4 ]
  • thallium(I) bromide [ No CAS ]
  • benzyltrimethylammonium octahydrotriborate(1-) [ No CAS ]
 

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