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Tetrahydrofuran → 5-Methylsulfonyltetrazole

HRID 2193835
Notes
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Reaction equation

HRID 2193835 reaction equation
CS[C:3]1[NH:7][N:6]=[N:5][N:4]=1.[S:8]([O-:13])(O[O-])(=O)=[O:9].[K+].[K+].[CH2:16]1COCC1>O>[CH3:16][S:8]([C:3]1[NH:7][N:6]=[N:5][N:4]=1)(=[O:13])=[O:9]
ParticipantsProcedureWorkupSources & evidenceReaction notes

Participants

5

Reactant 3

HCID 8028TetrahydrofuranHCID 10313463Potassium peroxymonosulphateHCID 178503621HCID 178503621, compound

Product 1

HCID 1785048625-Methylsulfonyltetrazole

Reagents, catalysts & solvents 1

HCID 962WaterSolvent

Procedure

To a stirred solution of 5-(methylthio)-1H-tetrazole (300 mg; Aldrich Chemical Company, Inc., Milwaukee, Wis.) in THF (15 mL) and water (15 mL) was added potassium peroxomonosulfate (Oxone®, DuPont Specialty Chemicals, Deepwater, N.J., USA) (3.18 g). After stirring at room temperature for five days, the reaction mixture was filtered and the filtercake was washed with THF. The filtrate was concentrated under reduced pressure. Crude NMR showed this to be a mixture of desired product and starting material, so the mixture was taken up in methanol and treated with potassium peroxomonosulfate (Oxone®, DuPont Specialty Chemicals, Deepwater, N.J., USA). After stirring at room temperature for five days, the reaction mixture was filtered and the filtercake was washed with methanol. The filtrate was concentrated under reduced pressure to afford 0.400 g of impure (I-11a) as a solid which was used in the next step without purification; m/z 146.9 (M−H)−.

Workup

  1. filtrationthe reaction mixture was filtered
  2. washthe filtercake was washed with THF
  3. concentrationThe filtrate was concentrated under reduced pressure
  4. additiona mixture of desired product
  5. additiontreated with potassium peroxomonosulfate (Oxone®, DuPont Specialty Chemicals, Deepwater, N.J., USA)
  6. stirringAfter stirring at room temperature for five days
  7. filtrationthe reaction mixture was filtered
  8. washthe filtercake was washed with methanol
  9. concentrationThe filtrate was concentrated under reduced pressure
  10. customto afford 0.400 g of impure (I-11a) as a solid which
  11. customwas used in the next step without purification

Sources & evidence

ORD record
ord-923f2d8ef9844d19a944a28c730aaa63
Source dataset
uspto-grants-2012_12
DOI
10.6084/m9.figshare.5104873.v1
Patent number
US08329920B2

Reaction notes

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