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Sodium Hydroxide → 5-(p-Chlorophenyl)-4-[(trifluoromethyl)thio]pyrrole-2-carboxylic acid

HRID 129634
Notes
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Reaction equation

HRID 129634 reaction equation
[Cl:1][C:2]1[CH:7]=[CH:6][C:5]([C:8]2[NH:12][C:11]([C:13]([O:15]C)=[O:14])=[CH:10][C:9]=2[S:17][C:18]([F:21])([F:20])[F:19])=[CH:4][CH:3]=1.[OH-].[Na+]>CO.O>[Cl:1][C:2]1[CH:7]=[CH:6][C:5]([C:8]2[NH:12][C:11]([C:13]([OH:15])=[O:14])=[CH:10][C:9]=2[S:17][C:18]([F:20])([F:19])[F:21])=[CH:4][CH:3]=1
ParticipantsConditionsProcedureWorkupSources & evidenceReaction notes

Participants

4

Reactant 2

HCID 14798Sodium HydroxideHCID 18930391Methyl 5-(p-chlorophenyl)-4-[(trifluoromethyl)thio]pyrrole-2-carboxylate

Product 1

HCID 189304125-(p-Chlorophenyl)-4-[(trifluoromethyl)thio]pyrrole-2-carboxylic acidYield 106%

Reagents, catalysts & solvents 1

HCID 22242641Methanol--water (1/1)Solvent

Conditions

Temperature
60 °C

Procedure

A mixture of methyl 5-(p-chlorophenyl)-4-[(trifluoromethyl)thio]pyrrole-2-carboxylate (4.89 g, 0.0146 mol) and sodium hydroxide (1.75 g, 0.0437 mol) in a 2:1 methanol/water solution (150 mL) is warmed to 60° C., stirred for three hours, cooled to room temperature with stirring overnight and concentrated in vacuo to remove most of the methanol. The resulting aqueous solution is treated with 10% hydrochloric acid and a white precipitate forms. Ethyl acetate is added and the organic phase is separated, washed with brine, dried over anhydrous magnesium sulfate and concentrated in vacuo to give the title product as an off-white solid (4.98 g, mp 176°-178° C.) which is identified by 1HNMR spectral analysis.

Workup

  1. temperaturecooled to room temperature
  2. stirringwith stirring overnight
  3. concentrationconcentrated in vacuo
  4. customto remove most of the methanol
  5. additionThe resulting aqueous solution is treated with 10% hydrochloric acid
  6. additionEthyl acetate is added
  7. customthe organic phase is separated
  8. washwashed with brine
  9. dry with materialdried over anhydrous magnesium sulfate
  10. concentrationconcentrated in vacuo

Sources & evidence

ORD record
ord-e196a6596d5541a7ad20af3a5fa7985e
Source dataset
uspto-grants-1995_11
DOI
10.6084/m9.figshare.5104873.v1
Patent number
US05468877

Reaction notes

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On this pageParticipantsConditionsProcedureWorkupSources & evidenceReaction notes