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3-Fluoroaniline → HCID 178509198, 화합물

HRID 2304446
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HRID 2304446 반응식
[F:1][C:2]1[CH:3]=[C:4]([NH:8][N:9]=[C:10]([C:13]#[N:14])[C:11]#[N:12])[CH:5]=[CH:6][CH:7]=1.FC1C=C(C=CC=1)N.C(CC(OC1CCCCC1)=O)#N.[OH2:35].[NH2:36]N>C(O)C>[NH2:14][C:13]1[C:10](=[N:9][NH:8][C:4]2[CH:5]=[CH:6][CH:7]=[C:2]([F:1])[CH:3]=2)[C:11](=[O:35])[NH:12][N:36]=1
참가 물질실험 절차후처리출처 및 근거반응 노트

참가 물질

6

반응물 4

HCID 97423-FluoroanilineHCID 24654Hydrazine hydrate (1:1)HCID 96357Cyclohexyl cyanoacetateHCID 4199695HCID 4199695, 화합물

생성물 1

HCID 178509198HCID 178509198, 화합물

시약·촉매·용매 1

HCID 702Ethanol용매

실험 절차

This compound was prepared using 2-[(3-fluorophenyl)hydrazono]malononitrile (145 mg, 0.5 mmole), which was derived from 3-fluoroaniline (111 mg, 1 mmole)) and cyclohexyl cyanoacetate (217 mg, 1.3 mmole) as described in Example 8, and hydrazine hydrate (25 mg, 0.5 mmole) in ethanol. Solids had not formed after heating the reaction at 80° C. for 40 minutes, however, analysis of the reaction solution by TLC indicated that no starting material remained. The solution was allowed to cool to room temperature and concentrated. The product was obtained after filtration as a yellow solid (73 mg). 1H NMR (ppm, DMSO-d6): 5.95 (br., s, 2H), 6.90 (m, 1H), 7.20-7.65 (m, 3H), 10.56 (br., s, 1H) 12.77 (br., s, 1H).

후처리

  1. customThis compound was prepared
  2. customSolids had not formed
  3. temperatureafter heating
  4. customthe reaction at 80° C. for 40 minutes
  5. concentrationconcentrated
  6. customThe product was obtained
  7. filtrationafter filtration as a yellow solid (73 mg)

출처 및 근거

ORD 기록
ord-c2ceccb492f845e68b224ee6ec0a4124
출처 데이터셋
uspto-grants-2002_08
DOI
10.6084/m9.figshare.5104873.v1
특허 번호
US06436915B1

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