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Potassium Cation → 3-Fluoro-2-(2-fluoro-5-nitrophenyl)pyridine

HRID 678115
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HRID 678115 반응식
[Br:1][c:2]1[n:3][cH:4][cH:5][cH:6][c:7]1[F:8].[F-:28].[F:9][c:10]1[c:11]([B:19]2[O:20][C:21]([CH3:22])([CH3:23])[C:24]([CH3:25])([CH3:26])[O:27]2)[cH:12][c:13]([N+:16](=[O:17])[O-:18])[cH:14][cH:15]1.[K+:29].[O:31]1[CH2:32][CH2:33][CH2:34][CH2:35]1.[O:38]=[C:39]([CH:40]=[CH:41][c:42]1[cH:43][cH:44][cH:45][cH:46][cH:47]1)[CH:48]=[CH:49][c:50]1[cH:51][cH:52][cH:53][cH:54][cH:55]1.[O:56]=[C:57]([CH:58]=[CH:59][c:60]1[cH:61][cH:62][cH:63][cH:64][cH:65]1)[CH:66]=[CH:67][c:68]1[cH:69][cH:70][cH:71][cH:72][cH:73]1.[O:74]=[C:75]([CH:76]=[CH:77][c:78]1[cH:79][cH:80][cH:81][cH:82][cH:83]1)[CH:84]=[CH:85][c:86]1[cH:87][cH:88][cH:89][cH:90][cH:91]1.[OH2:30].[Pd:36].[Pd:37]>>[c:2]1(-[c:11]2[c:10]([F:9])[cH:15][cH:14][c:13]([N+:16](=[O:17])[O-:18])[cH:12]2)[n:3][cH:4][cH:5][cH:6][c:7]1[F:8]
참가 물질출처 및 근거반응 노트

참가 물질

9

반응물 8

HCID 813Potassium CationHCID 962WaterHCID 8028TetrahydrofuranHCID 23938Palladium2회HCID 28179Fluoride IonHCID 95417Dibenzylidene acetone3회HCID 27628032-Bromo-3-fluoropyridine
HCID 3833297
2-Fluoro-5-nitrophenylboronic acid, pinacol ester

생성물 1

HCID 222853393-Fluoro-2-(2-fluoro-5-nitrophenyl)pyridine

출처 및 근거

ORD 기록
ord-7cdc4154b2864f96a09bcc7dc4321cb6
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI
10.1039/C8SC04228D

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