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Acetic Acid → Tert-butyl [2-fluoro-5-(methylamino)phenyl]carbamate

HRID 1800694
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HRID 1800694 반응식
[F:1][C:2]1[CH:7]=[CH:6][C:5]([NH:8][CH:9]=O)=[CH:4][C:3]=1[NH:11][C:12](=[O:18])[O:13][C:14]([CH3:17])([CH3:16])[CH3:15].CO.C(O)(=O)C>O1CCCC1>[F:1][C:2]1[CH:7]=[CH:6][C:5]([NH:8][CH3:9])=[CH:4][C:3]=1[NH:11][C:12](=[O:18])[O:13][C:14]([CH3:16])([CH3:15])[CH3:17]
참가 물질실험 절차후처리출처 및 근거반응 노트

참가 물질

5

반응물 3

HCID 176Acetic AcidHCID 887MethanolHCID 86646074HCID 86646074, 화합물

생성물 1

HCID 86646076Tert-butyl [2-fluoro-5-(methylamino)phenyl]carbamate수율 73%

시약·촉매·용매 1

HCID 8028Tetrahydrofuran용매

실험 절차

To a solution of the above-mentioned crude product of tert-butyl [2-fluoro-5-(formylamino)phenyl]carbamate in tetrahydrofuran (100 mL) was added borane dimethylsulfide complex (11.7 mL, 111 mmol), and the mixture was stirred at room temperature for 1.5 hr. To the reaction mixture were successively added methanol (20 mL) and acetic acid (10 mL), and the mixture was stirred at room temperature for 30 min. The reaction mixture was concentrated under reduced pressure. To the obtained residue was added saturated aqueous sodium hydrogen carbonate solution (100 mL), and the mixture was extracted with ethyl acetate (100 mL, 30 mL). The combined organic layer was washed with saturated brine (20 mL), and dried over anhydrous sodium sulfate. The insoluble material was filtered off, and the filtrate was concentrated under reduced pressure. The obtained residue was purified by silica gel column chromatography (hexane/ethyl acetate=100/0→90/10), and the fractions containing the object product were concentrated under reduced pressure to give the title compound (7.80 g, 73%) as a yellow oil.

후처리

  1. stirringthe mixture was stirred at room temperature for 30 min
  2. concentrationThe reaction mixture was concentrated under reduced pressure
  3. additionTo the obtained residue was added saturated aqueous sodium hydrogen carbonate solution (100 mL)
  4. extractionthe mixture was extracted with ethyl acetate (100 mL, 30 mL)
  5. washThe combined organic layer was washed with saturated brine (20 mL)
  6. dry with materialdried over anhydrous sodium sulfate
  7. filtrationThe insoluble material was filtered off
  8. concentrationthe filtrate was concentrated under reduced pressure
  9. customThe obtained residue was purified by silica gel column chromatography (hexane/ethyl acetate=100/0→90/10)
  10. additionthe fractions containing the object product
  11. concentrationwere concentrated under reduced pressure

출처 및 근거

ORD 기록
ord-49dda0c3547f4bd39fd08108d7e549aa
출처 데이터셋
uspto-grants-2013_01
DOI
10.6084/m9.figshare.5104873.v1
특허 번호
US08344135B2

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