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1-Ethyl-3-(3'-dimethylaminopropyl)carbodiimide → HCID 57385047, 화합물

HRID 83597
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HRID 83597 반응식
[Cl:1][C:2]1[CH:20]=[CH:19][C:5]([CH2:6][N:7]2[C:15]3[C:10](=[CH:11][CH:12]=[CH:13][CH:14]=3)[CH:9]=[C:8]2[C:16]([OH:18])=O)=[CH:4][CH:3]=1.C(N=C=NCCCN(C)C)C.O.ON1C2C=CC=CC=2N=N1.C(N(CC)C(C)C)(C)C.[NH:52]1[CH2:57][CH2:56][CH:55]([C:58]([O:60][CH2:61][CH3:62])=[O:59])[CH2:54][CH2:53]1>C(Cl)Cl.C(OCC)(=O)C.O>[Cl:1][C:2]1[CH:20]=[CH:19][C:5]([CH2:6][N:7]2[C:15]3[C:10](=[CH:11][CH:12]=[CH:13][CH:14]=3)[CH:9]=[C:8]2[C:16]([N:52]2[CH2:57][CH2:56][CH:55]([C:58]([O:60][CH2:61][CH3:62])=[O:59])[CH2:54][CH2:53]2)=[O:18])=[CH:4][CH:3]=1
참가 물질실험 절차후처리출처 및 근거반응 노트

참가 물질

9

반응물 5

HCID 159081-Ethyl-3-(3'-dimethylaminopropyl)carbodiimideHCID 70770Ethyl 4-piperidinecarboxylateHCID 81531DiisopropylethylamineHCID 27960291-Hydroxybenzotriazole hydrateHCID 223108991-(4-Chlorobenzyl)-1H-indole-2-carboxylic acid

생성물 1

HCID 57385047HCID 57385047, 화합물

시약·촉매·용매 3

HCID 962Water용매HCID 6344Dichloromethane용매HCID 8857Ethyl Acetate용매

실험 절차

1-(4-chlorobenzyl)-1H-indole-2-carboxylic acid (2.4 g, 8.40 mmol), 1-ethyl-3-(3-dimethylaminopropyl) carbodiimide (2.4 g, 12.60 mmol), and 1-Hydroxybenzotriazole hydrate (1.9 g, 12.60 mmol) were dissolved in 20.0 mL of DCM. The resulting suspension was stirred for twenty minutes where it turned into a clear, yellow solution. N,N-Diisopropylethylamine (2.2 mL, 12.60 mmol) and ethyl piperidine-4-carboxylate (1.94 mL, 12.60 mmol) were added to the reaction. The reaction was stirred overnight. Water was added to the reaction followed by ethyl acetate. The layers were separated and the organic layer was washed sequentially with 1N HCl, saturated sodium bicarbonate, and saturated sodium chloride. The organic layer was dried over magnesium sulfate, filtered and concentrated. The resulting crude mixture was triturated with diethyl ether to obtain pure product as a white solid. Yield: 2.79 g, (White solid)

후처리

  1. stirringThe reaction was stirred overnight
  2. customThe layers were separated
  3. washthe organic layer was washed sequentially with 1N HCl, saturated sodium bicarbonate, and saturated sodium chloride
  4. dry with materialThe organic layer was dried over magnesium sulfate
  5. filtrationfiltered
  6. concentrationconcentrated
  7. customThe resulting crude mixture was triturated with diethyl ether
  8. customto obtain pure product as a white solid

출처 및 근거

ORD 기록
ord-35b54fda9c3a4b158ffd6c2bbb3d8f0d
출처 데이터셋
uspto-grants-2014_09
DOI
10.6084/m9.figshare.5104873.v1
특허 번호
US08846684B2

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