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Acetic Acid → 2-Bromo-7-hydroxy-3-(3-methyl-2-buten-1-yl)-3,5,6,7-tetrahydro-imidazo[4,5-c]pyridin-4-one

HRID 230106
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HRID 230106 반응식
O.[Br:2][C:3]1[N:7]([CH2:8][CH:9]=[C:10]([CH3:12])[CH3:11])[C:6]([C:13](OC)=[O:14])=[C:5]([CH:17]([OH:22])[CH2:18][N+:19]([O-])=O)[N:4]=1.C(O)(=O)C>C(O)C.[Fe]>[Br:2][C:3]1[N:7]([CH2:8][CH:9]=[C:10]([CH3:12])[CH3:11])[C:6]2[C:13](=[O:14])[NH:19][CH2:18][CH:17]([OH:22])[C:5]=2[N:4]=1
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참가 물질

6

반응물 3

HCID 176Acetic AcidHCID 962WaterHCID 67435131Methyl 2-bromo-5-(1-hydroxy-2-nitro-ethyl)-3-(3-methyl-2-buten-1-yl)-3H-imidazole-4-carboxylate

생성물 1

HCID 674358652-Bromo-7-hydroxy-3-(3-methyl-2-buten-1-yl)-3,5,6,7-tetrahydro-imidazo[4,5-c]pyridin-4-one

시약·촉매·용매 2

HCID 23925Iron촉매
HCID 702
Ethanol
용매

실험 절차

90 ml of water and 5.40 g iron powder are added to 4.15 g methyl 2-bromo-5-(1-hydroxy-2-nitro-ethyl)-3-(3-methyl-2-buten-1-yl)-3H-imidazole-4-carboxylate in 270 ml of ethanol. The mixture is refluxed, combined with 36 ml glacial acetic acid and stirred for one and a half hours at reflux temperature. The cooled reaction solution is filtered through Celite. The filtrate is evaporated down, combined with ethanol and made basic with solid potassium carbonate. The mixture is stirred for three hours at 60° C. Then the ethanol is distilled off, the flask residue is combined with water and extracted with ethyl acetate. The combined extracts are dried over magnesium sulphate and evaporated down. The crude product is purified by chromatography over a silica gel column with methylene chloride/methanol (1:1 to 7:1) as eluant.

후처리

  1. temperatureThe mixture is refluxed
  2. temperatureat reflux temperature
  3. customThe cooled reaction solution
  4. filtrationis filtered through Celite
  5. customThe filtrate is evaporated down
  6. stirringThe mixture is stirred for three hours at 60° C
  7. distillationThen the ethanol is distilled off
  8. extractionextracted with ethyl acetate
  9. dry with materialThe combined extracts are dried over magnesium sulphate
  10. customevaporated down
  11. customThe crude product is purified by chromatography over a silica gel column with methylene chloride/methanol (1:1 to 7:1) as eluant

출처 및 근거

ORD 기록
ord-c998851b96fd44ca9575b717c21191b8
출처 데이터셋
uspto-grants-2009_07
DOI
10.6084/m9.figshare.5104873.v1
특허 번호
US07566707B2

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