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4-Toluenesulfonyl chloride → 2-Tosylthiophene

HRID 2267332
Notes
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Reaction equation

HRID 2267332 reaction equation
[C:1]1([CH3:11])[CH:6]=[CH:5][C:4]([S:7](Cl)(=[O:9])=[O:8])=[CH:3][CH:2]=1.[S:12]1[CH:16]=[CH:15][CH:14]=[CH:13]1>C(#N)C.[Cl-].[Zn+2].[Cl-]>[S:7]([C:13]1[S:12][CH:16]=[CH:15][CH:14]=1)([C:4]1[CH:5]=[CH:6][C:1]([CH3:11])=[CH:2][CH:3]=1)(=[O:9])=[O:8]
ParticipantsProcedureWorkupSources & evidenceReaction notes

Participants

5

Reactant 2

HCID 73974-Toluenesulfonyl chlorideHCID 8030Thiophene

Product 1

HCID 2555212-TosylthiopheneYield 95.5%

Reagents, catalysts & solvents 2

HCID 3007855ZincchlorideCatalystHCID 6342AcetonitrileSolvent

Procedure

A mixture of p-toluenesulfonyl chloride (3 g, 15.7 mmol) and zinc chloride (3 g, 21.3 mmol) in acetonitrile (30 mL) was heated to reflux and thiophene (2.4 g, 28.5 mmol) was added dropwise. After refluxing for 4 h the mixture was cooled to rt and filtered through Celite. The filtrate was concentrated in vacuo and then 100 mL of sodium hydroxide (2 N) was added. The mixture was extracted with ethyl acetate (3×60 mL) and the combined organic layers were washed with hydrochloric acid (10%, 50 mL) and brine (100 mL), dried over anhydrous magnesium sulfate and filtered. The solvent was evaporated in vacuo and the product was purified by flash chromatography eluting with dichloromethane/hexane (2:3) to give the title compound (0.54 g, 15 mmol).

Workup

  1. temperaturewas heated
  2. temperatureto reflux
  3. temperatureAfter refluxing for 4 h the mixture
  4. filtrationfiltered through Celite
  5. concentrationThe filtrate was concentrated in vacuo
  6. addition100 mL of sodium hydroxide (2 N) was added
  7. extractionThe mixture was extracted with ethyl acetate (3×60 mL)
  8. washthe combined organic layers were washed with hydrochloric acid (10%, 50 mL) and brine (100 mL)
  9. dry with materialdried over anhydrous magnesium sulfate
  10. filtrationfiltered
  11. customThe solvent was evaporated in vacuo
  12. customthe product was purified by flash chromatography
  13. washeluting with dichloromethane/hexane (2:3)

Sources & evidence

ORD record
ord-dcd43305a0ed45b6af4702663bdb4623
Source dataset
uspto-grants-2010_12
DOI
10.6084/m9.figshare.5104873.v1
Patent number
US07858785B2

Reaction notes

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On this pageParticipantsProcedureWorkupSources & evidenceReaction notes