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Nitrogen → 3-(4-pyridinyl)-1H-indazole-5-carboxaldehyde

HRID 218454
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반응식

HRID 218454 반응식
I[C:2]1[C:10]2[C:5](=[CH:6][CH:7]=[C:8]([CH:11]=[O:12])[CH:9]=2)[NH:4][N:3]=1.[N:13]1[CH:18]=[CH:17][C:16](B(O)O)=[CH:15][CH:14]=1.C([O-])([O-])=O.[Na+].[Na+].N#N>C1(C)C=CC=CC=1.CCO.O.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>[N:13]1[CH:18]=[CH:17][C:16]([C:2]2[C:10]3[C:5](=[CH:6][CH:7]=[C:8]([CH:11]=[O:12])[CH:9]=3)[NH:4][N:3]=2)=[CH:15][CH:14]=1
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참가 물질

8

반응물 4

HCID 947NitrogenHCID 10340Sodium CarbonateHCID 2734379(Pyridin-4-yl)boronic acidHCID 178519380HCID 178519380, 화합물

생성물 1

HCID 249587413-(4-pyridinyl)-1H-indazole-5-carboxaldehyde수율 64.2%

시약·촉매·용매 3

HCID 178418397
HCID 178418397, 화합물
촉매
HCID 962Water용매
HCID 21863594Toluene ethanol용매

실험 절차

To a suspension of 3-iodo-1H-indazole-5-carboxaldehyde (200 mg, 0.74 mmol) and 4-pyridineboronic acid (110 mg, 0.89 mmol) in toluene/EtOH (1:1, 8 mL) in a sealed tube was added Na2CO3 (2 N, 1 mL) followed by Pd(PPh3)4 (85 mg, 0.074 mmol). The reaction mixture was put under vacuum, and re-charged with N2 three times, then kept at ca. 100-110° C. for ca. 4-5 hr. The reaction mixture was cooled to rt, diluted with water, and extracted with EtOAc. The organic phase was washed with brine, and dried. Concentration followed by purification by flash chromatography afforded 3-(4-pyridinyl)-1H-indazole-5-carboxaldehyde (106 mg, 64%).

후처리

  1. extractionextracted with EtOAc
  2. washThe organic phase was washed with brine
  3. customdried
  4. concentrationConcentration
  5. customfollowed by purification by flash chromatography

출처 및 근거

ORD 기록
ord-219364dd8b984b338fcabb445a1c3809
출처 데이터셋
uspto-grants-2012_06
DOI
10.6084/m9.figshare.5104873.v1
특허 번호
US08198456B2

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