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Triethylamine → 2-Cyano-3-fluoropyridine

HRID 7150
Notes
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Reaction equation

HRID 7150 reaction equation
[F:1][C:2]1[CH:3]=[N+:4]([O-])[CH:5]=[CH:6][CH:7]=1.C[CH2:10][N:11](CC)CC.[Si](C#N)(C)(C)C>CC#N.C(Cl)Cl>[F:1][C:2]1[C:3]([C:10]#[N:11])=[N:4][CH:5]=[CH:6][CH:7]=1
ParticipantsProcedureWorkupSources & evidenceReaction notes

Participants

6

Reactant 3

HCID 8471TriethylamineHCID 82115Trimethylsilyl cyanideHCID 123084Pyridine, 3-fluoro-, 1-oxide

Product 1

HCID 70604082-Cyano-3-fluoropyridineYield 77.3%

Reagents, catalysts & solvents 2

HCID 6342AcetonitrileSolventHCID 6344
Dichloromethane
Solvent

Procedure

To a solution of 3-fluoropyridine 1-oxide (1.21 g, 10.7 mmol) in CH3CN (10 mL) was added Et3N (4.4 mL, 31.6 mmol) followed by TMSCN (4.3 mL, 32.2 mmol) and the reaction was stirred at reflux for 6.5 hours. The mixture was diluted with CH2Cl2 (100 mL) and washed with saturated aqueous NaHCO3 (50 mL). The aqueous layer was extracted with CH2Cl2 (3×40 mL) and the combined organic layers were dried (Na2SO4), filtered and concentrated to give a crude dark red oil. Purification of the crude material by column chromatography on silica gel (CH2Cl2/MeOH, 98:2) afforded the title compound as a yellow solid (1.01 g, 77%). 1H NMR (CDCl3): δ 7.58–7.67 (m, 2H), 8.54–8.57 (m, 1H).

Workup

  1. temperatureat reflux for 6.5 hours
  2. washwashed with saturated aqueous NaHCO3 (50 mL)
  3. extractionThe aqueous layer was extracted with CH2Cl2 (3×40 mL)
  4. dry with materialthe combined organic layers were dried (Na2SO4)
  5. filtrationfiltered
  6. concentrationconcentrated
  7. customto give a crude dark red oil
  8. customPurification of the crude material by column chromatography on silica gel (CH2Cl2/MeOH, 98:2)

Sources & evidence

ORD record
ord-6d7df6fce5eb41f7a498dfec62199b0a
Source dataset
uspto-grants-2006_08
DOI
10.6084/m9.figshare.5104873.v1
Patent number
US07084155B2

Reaction notes

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On this pageParticipantsProcedureWorkupSources & evidenceReaction notes