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Potassium Phosphate, Tribasic → Methyl 3-(4-ethylphenyl)-5-methylthiophene-2-carboxylate

HRID 2177344
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HRID 2177344 반응식
[CH3:1][C:2]1[S:6][C:5]([C:7]([O:9][CH3:10])=[O:8])=[C:4](OS(C(F)(F)F)(=O)=O)[CH:3]=1.[CH2:19]([C:21]1[CH:26]=[CH:25][C:24](B(O)O)=[CH:23][CH:22]=1)[CH3:20].[O-]P([O-])([O-])=O.[K+].[K+].[K+]>C1C=CC([P]([Pd]([P](C2C=CC=CC=2)(C2C=CC=CC=2)C2C=CC=CC=2)([P](C2C=CC=CC=2)(C2C=CC=CC=2)C2C=CC=CC=2)[P](C2C=CC=CC=2)(C2C=CC=CC=2)C2C=CC=CC=2)(C2C=CC=CC=2)C2C=CC=CC=2)=CC=1.O1CCOCC1>[CH2:19]([C:21]1[CH:26]=[CH:25][C:24]([C:4]2[CH:3]=[C:2]([CH3:1])[S:6][C:5]=2[C:7]([O:9][CH3:10])=[O:8])=[CH:23][CH:22]=1)[CH3:20]
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참가 물질

6

반응물 3

HCID 62657Potassium Phosphate, TribasicHCID 2734352Boronic acid, (4-ethylphenyl)-HCID 90418547Methyl 5-methyl-3-(((trifluoromethyl)sulfonyl)oxy)thiophene-2-carboxylate

생성물 1

HCID 90418379Methyl 3-(4-ethylphenyl)-5-methylthiophene-2-carboxylate

시약·촉매·용매 2

HCID 178418397HCID 178418397, 화합물
촉매
HCID 312751,4-Dioxane용매

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온도
80 °C

실험 절차

Into a 50-mL sealed tube (1 atm) purged and maintained with an inert atmosphere of nitrogen, was placed methyl 5-methyl-3-(((trifluoro methyl)sulfonyl)oxy)thiophene-2-carboxylate (1.7 g, 5.59 mmol), (4-ethylphenyl)boronic acid (1.0 g, 6.69 mmol), K3PO4 (3.84 g, 18.1 mmol), Pd(PPh3)4 (157 mg, 0.136 mmol), 1,4-dioxane (40 mL). The resulting solution was stirred overnight at 80° C. in an oil bath. The reaction progress was monitored by TLC/LCMS (ethyl acetate/petroleum ether=1:6). The solids were filtered out and washed by 20 mL ethyl acetate. Collected the organic phases and concentrated under vacuum. The residue was applied onto a silica gel column with ethyl acetate/petroleum ether (1:10). This resulted in 1.46 g (100%) of methyl 3-(4-ethylphenyl)-5-methylthiophene-2-carboxylate as light yellow oil.

후처리

  1. customInto a 50-mL sealed tube (1 atm)
  2. custompurged
  3. temperaturemaintained with an inert atmosphere of nitrogen
  4. filtrationThe solids were filtered out
  5. washwashed by 20 mL ethyl acetate
  6. customCollected the organic phases
  7. concentrationconcentrated under vacuum
  8. customThis resulted in 1.46 g (100%) of methyl 3-(4-ethylphenyl)-5-methylthiophene-2-carboxylate as light yellow oil

출처 및 근거

ORD 기록
ord-43bdae2a1bef4e3c9dfba5f358638831
출처 데이터셋
uspto-grants-2015_06
DOI
10.6084/m9.figshare.5104873.v1
특허 번호
US09067898B1

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