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Hydrochloric Acid → 5-Isothiazolecarboxylic acid, 3-(3-(trifluoromethyl)phenyl)-

HRID 67649
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HRID 67649 반응식
[F:1][C:2]([F:19])([F:18])[C:3]1[CH:4]=[C:5]([C:9]2[CH:13]=[C:12]([C:14]([O:16]C)=[O:15])[S:11][N:10]=2)[CH:6]=[CH:7][CH:8]=1.[OH-].[K+].Cl.FC(F)(F)C1C=C(C2C=C(C([O-])=O)SN=2)C=CC=1>>[F:19][C:2]([F:1])([F:18])[C:3]1[CH:4]=[C:5]([C:9]2[CH:13]=[C:12]([C:14]([OH:16])=[O:15])[S:11][N:10]=2)[CH:6]=[CH:7][CH:8]=1
참가 물질실험 절차후처리출처 및 근거반응 노트

참가 물질

5

반응물 4

HCID 313Hydrochloric AcidHCID 14797Potassium HydroxideHCID 13073224Methyl 3-(3-trifluoromethylphenyl)-5-isothiazolecarboxylateHCID 867385453-(3-Trifluoromethylphenyl)-5-isothiazolecarboxylate

생성물 1

HCID 30679245-Isothiazolecarboxylic acid, 3-(3-(trifluoromethyl)phenyl)-수율 85%

실험 절차

A solution of 1.6 g. of methyl 3-(3-trifluoromethylphenyl)-5-isothiazolecarboxylate in 30 ml. of 95% alcohol containing 1.0 g. of potassium hydroxide was heated at reflux for one hour. The reaction mixture then was added to 50 g. of ice, and the aqueous solution was acidified by the addition of 12 N aqueous hydrochloric acid. The product which precipitated was collected by filtration and crystallized from toluene and hexane to provide 1.3 g. of 3-(3-trifluoromethylphenyl)-5-isothiazolecarboxylate acid. Yield 85%. M.P. 162.5°-164° C.

후처리

  1. temperatureat reflux for one hour
  2. additionThe reaction mixture then was added to 50 g
  3. customThe product which precipitated
  4. filtrationwas collected by filtration
  5. customcrystallized from toluene and hexane
  6. customto provide 1.3 g

출처 및 근거

ORD 기록
ord-7997b32bf61d49c8a04a6b7b00f35295
출처 데이터셋
uspto-grants-1982_08
DOI
10.6084/m9.figshare.5104873.v1
특허 번호
US04346094

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