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Hydrochloric Acid → 2,2,3,3-Tetrafluoro-5-nitrobenzofuran

HRID 35692
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HRID 35692 반응식
Cl[C:2]1[CH:3]=[C:4]([N+:16]([O-:18])=[O:17])[CH:5]=[CH:6][C:7]=1[O:8][C:9]([F:15])([F:14])[C:10](Br)([F:12])[F:11].N1C=CC=CC=1C1C=CC=CN=1.CS(C)=O.Cl>CC1CCCCC1.[Cu]>[F:14][C:9]1([F:15])[C:10]([F:12])([F:11])[C:2]2[CH:3]=[C:4]([N+:16]([O-:18])=[O:17])[CH:5]=[CH:6][C:7]=2[O:8]1
참가 물질실험 절차후처리출처 및 근거반응 노트

참가 물질

7

반응물 4

HCID 313Hydrochloric AcidHCID 679Dimethyl SulfoxideHCID 14742,2'-BipyridineHCID 137849851-(2-Bromo-1,1,2,2-tetrafluoroethoxy)-2-chloro-4-nitrobenzene

생성물 1

HCID 137849862,2,3,3-Tetrafluoro-5-nitrobenzofuran수율 311.8%

시약·촉매·용매 2

HCID 23978
Copper
촉매
HCID 7962Methylcyclohexane용매

실험 절차

Into a pressure bottle was placed 10.0 g (0.028 mole) 3-chloro-4-(2-bromo-1,1,2,2-tetrafluoroethoxy)nitrobenzene, 9.0 g (0.14 mole) copper powder (200 mesh), 0.45 g (0.0028 mole) 2,2'-bipyridyl, and 40 mL of dimethylsulfoxide. The pressure bottle was sealed and the reaction mixture stirred at 190°-195° C. for two hours. The pressure bottle was cooled to room temperature, opened, and the contents poured into a separatory funnel. Approximately 200 mL of a 2N hydrochloric acid solution was added to the separatory funnel. The mixture was extracted with three 150 mL portions of diethyl ether. The extracts were combined and washed in succession with 200 mL of a 2N hydrochloric acid solution, 200 mL of a saturated aqueous sodium chloride solution, and 200 mL of a 2N sodium hydroxide solution. The washed extract was dried over anhydrous magnesium sulfate and filtered. The solvent was evaporated under reduced pressure leaving an oil. The reaction described above was repeated six additional times. The residual oils from the seven experiments were combined and subjected to column chromatography on silica gel, eluting with toluene, to yield a yellow oil. This oil was dissolved in 125 mL methylcyclohexane and the solution placed in a freezer for approximately 18 hours. Crystals had formed and were collected by filtration to yield 20.7 g 2,3-dihydro-2,2,3,3-tetrafluoro-5-nitrobenzofuran. The filtrate was evaporated under reduced pressure leaving an oil. Distillation of this oil under reduced pressure provided an additional 3.0 g of product (bp 75° C./0.2 mm). Hydrogenation of 2.15 g (0.011 mole) 2,3-dihydro-2,2,3,3-tetrafluoro-5-nitrobenzofuran with a catalytic amount (0.25 g) of platinum oxide in 150 mL of methanol produced 2.15 g of 5-amino-2,3-dihydro-2,2,3,3-tetrafluorobenzofuran.

후처리

  1. customThe pressure bottle was sealed
  2. additionthe contents poured into a separatory funnel
  3. extractionThe mixture was extracted with three 150 mL portions of diethyl ether
  4. washwashed in succession with 200 mL of a 2N hydrochloric acid solution, 200 mL of a saturated aqueous sodium chloride solution, and 200 mL of a 2N sodium hydroxide solution
  5. extractionThe washed extract
  6. dry with materialwas dried over anhydrous magnesium sulfate
  7. filtrationfiltered
  8. customThe solvent was evaporated under reduced pressure
  9. customleaving an oil
  10. washeluting with toluene
  11. customto yield a yellow oil
  12. waitthe solution placed in a freezer for approximately 18 hours
  13. customCrystals had formed
  14. filtrationwere collected by filtration

출처 및 근거

ORD 기록
ord-cbb17279bbee45858b67aa3d5fcde92f
출처 데이터셋
uspto-grants-1988_08
DOI
10.6084/m9.figshare.5104873.v1
특허 번호
US04767779

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