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Ethyl 4-isocyanatobenzoate → HCID 9808166, 화합물

HRID 412070
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HRID 412070 반응식
[OH:1][CH2:2][C:3]1[N:4]=[CH:5][N:6]([C:8]2[CH:9]=[C:10]3[C:15](=[CH:16][C:17]=2[C:18]([F:21])([F:20])[F:19])[NH:14][C:13](=[O:22])[C:12]([C:23]([O:25][CH2:26][CH3:27])=[O:24])=[CH:11]3)[CH:7]=1.[N:28]([C:31]1[CH:41]=[CH:40][C:34]([C:35]([O:37][CH2:38][CH3:39])=[O:36])=[CH:33][CH:32]=1)=[C:29]=[O:30]>C(OCC)(=O)C>[CH2:38]([O:37][C:35]([C:34]1[CH:40]=[CH:41][C:31]([NH:28][C:29]([O:1][CH2:2][C:3]2[N:4]=[CH:5][N:6]([C:8]3[CH:9]=[C:10]4[C:15](=[CH:16][C:17]=3[C:18]([F:20])([F:21])[F:19])[NH:14][C:13](=[O:22])[C:12]([C:23]([O:25][CH2:26][CH3:27])=[O:24])=[CH:11]4)[CH:7]=2)=[O:30])=[CH:32][CH:33]=1)=[O:36])[CH3:39]
참가 물질실험 절차후처리출처 및 근거반응 노트

참가 물질

4

반응물 2

HCID 589805Ethyl 4-isocyanatobenzoateHCID 9951850HCID 9951850, 화합물

생성물 1

HCID 9808166HCID 9808166, 화합물수율 98.2%

시약·촉매·용매 1

HCID 8857Ethyl Acetate용매

실험 절차

To a suspension of the compound of Example 17 (768 mg, 2.01 mmol) in ethyl acetate (30 ml) was added ethyl 4-isocyanatobenzoate (769 mg, 4.02 mmol), and the mixture was refluxed for 48 hours. After cooling with ice, the precipitated crystals were collected by filtration, washed with ethyl acetate, and then dried under reduced pressure, thereby obtaining 1.13 g of title compound as colorless powder. Yield 98%.

후처리

  1. temperaturethe mixture was refluxed for 48 hours
  2. temperatureAfter cooling with ice
  3. filtrationthe precipitated crystals were collected by filtration
  4. washwashed with ethyl acetate
  5. customdried under reduced pressure

출처 및 근거

ORD 기록
ord-d5ce9b49ddf94421b6fcd7405a9fc2b5
출처 데이터셋
uspto-grants-2003_05
DOI
10.6084/m9.figshare.5104873.v1
특허 번호
US06562839B1

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