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llms.txt · MCP 가이드개인정보처리방침 · 이용약관 · 지원v1.8.0
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1,2,3,4-Tetrahydroisoquinoline → methyl 4-(3,4-dihydro-1H-isoquinolin-2-yl)benzoate

HRID 484
노트
인쇄 미리보기

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HRID 484 반응식
COC(=O)c1ccc(Br)cc1.c1ccc2c(c1)CCNC2>CC(=O)O.CC(=O)O.Cc1ccccc1.O=C([O-])[O-].[Cs+].[Cs+].[Pd].c1ccc(P(c2ccccc2)c2ccc3ccccc3c2-c2c(P(c3ccccc3)c3ccccc3)ccc3ccccc23)cc1>COC(=O)c1ccc(N2CCc3ccccc3C2)cc1
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참가 물질

7

반응물 2

HCID 70461,2,3,4-TetrahydroisoquinolineHCID 12081Methyl 4-bromobenzoate

생성물 1

HCID 57327469methyl 4-(3,4-dihydro-1H-isoquinolin-2-yl)benzoate수율 0%

시약·촉매·용매 4

HCID 10796Cesium carbonate시약HCID 634876Binap, (A+-)-촉매HCID 4144353

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온도
100 °C

실험 절차

methyl 4-bromobenzoate (100 mg, 0.47 mmol), [Reactants] and Cesium carbonate (152 mg, 0.47 mmol) were mixed in toluene (4 mL) and degassed by bubbling nitrogen through solution. Palladium acetate (5.22 mg, 0.02 mmol) and rac-2,2'-Bis(diphenylphosphino)-1,1'-binaphthyl (20.27 mg, 0.03 mmol) were added and the vial was capped and heated at 100°C over 5 days. Product had formed in mixture. Workup by dilution with EtOAc, washing with water, then extraction with 2M HCl. The HCl extract was neutralized with 2M NaOH and extracted with EtOAc and the EtOAc phase was dried (K2CO3) and evaporated to give the crude product. No product. Discarded.

출처 및 근거

ORD 기록
ord-d7ba527a2d2d4d7591368f0e50bee26a
출처 데이터셋
750 AstraZeneca ELN dataset
원본 링크
출처 보기

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이 페이지에서참가 물질반응 조건실험 절차출처 및 근거반응 노트
Palladium (II) acetate
촉매
HCID 1140Toluene용매