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Sodium hydride → HCID 66746957, 화합물

HRID 711823
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HRID 711823 반응식
[OH:1][CH2:2][C:3]([CH3:11])([CH3:10])[C:4]([NH:6][CH2:7][CH2:8][CH3:9])=[O:5].[H-].[Na+].[N+:14]([C:17]1[CH:24]=[CH:23][CH:22]=[C:21]([N+]([O-])=O)[C:18]=1[C:19]#[N:20])([O-:16])=[O:15]>C1COCC1>[C:19]([C:18]1[C:17]([N+:14]([O-:16])=[O:15])=[CH:24][CH:23]=[CH:22][C:21]=1[O:1][CH2:2][C:3]([CH3:10])([CH3:11])[C:4]([NH:6][CH2:7][CH2:8][CH3:9])=[O:5])#[N:20]
참가 물질반응 조건실험 절차후처리출처 및 근거반응 노트

참가 물질

5

반응물 3

HCID 24758Sodium hydrideHCID 520718DinitrobenzonitrileHCID 584610273-Hydroxy-2,2-dimethyl-N-propylpropanamide

생성물 1

HCID 66746957HCID 66746957, 화합물수율 72.4%

시약·촉매·용매 1

HCID 8028Tetrahydrofuran용매

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온도
0 °C

실험 절차

To a solution of 3-hydroxy-2,2-dimethyl-N-propylpropanamide (1.59 g, 10.0 mmol) (Example 215d) in dry THF (30 mL) was carefully added NaH (60% in mineral oil, 400 mg, 10.0 mmol) in small portions at 0° C. under nitrogen. The reaction mixture was stirred at 0° C. under nitrogen for 2 hrs. To this solution was added 2,6-dinitrobenzonitrile (1.93, 10.0 mmol), and the reaction solution was stirred at 0° C.—RT under nitrogen overnight. The reaction mixture was quenched with brine, and extracted with EtOAc (3×). The combined organic layers were washed with brine, dried over Na2SO4. After evaporation of the solvent, the residue was purified by chromatography on silica gel eluting with 60% EtOAc in hexanes to give the title compound as a pale yellow solid (2.21 g, 72%). MS 306 (MH+).

후처리

  1. customat 0° C.
  2. stirringthe reaction solution was stirred at 0° C.—RT under nitrogen overnight
  3. customThe reaction mixture was quenched with brine
  4. extractionextracted with EtOAc (3×)
  5. washThe combined organic layers were washed with brine
  6. dry with materialdried over Na2SO4
  7. customAfter evaporation of the solvent
  8. customthe residue was purified by chromatography on silica gel eluting with 60% EtOAc in hexanes

출처 및 근거

ORD 기록
ord-ae2337243cdd42beb9610b757b975322
출처 데이터셋
uspto-grants-2015_11
DOI
10.6084/m9.figshare.5104873.v1
특허 번호
US09181276B2

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