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Sodium Ion → 3-(5-Fluoro-2-pyridyl)-5-(3-fluoro-5-(3-pyridyl)phenyl)-1,2,4-oxadiazole

HRID 314653
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인쇄 미리보기

반응식

HRID 314653 반응식
[CH2:21]([OH:22])[CH2:23][CH2:24][OH:25].[CH3:130][CH2:131][O:132][C:133](=[O:134])[CH3:135].[CH3:35][O:36][CH2:37][CH2:38][O:39][CH3:40].[CH3:47][CH2:48][CH2:49][CH2:50][CH2:51][CH3:52].[F:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[n:9][o:10][c:11](-[c:13]3[cH:14][c:15]([Br:20])[cH:16][c:17]([F:19])[cH:18]3)[n:12]2)[n:6][cH:7]1.[Na+:41].[Na+:42].[O-:43][C:44](=[O:45])[O-:46].[cH:53]1[cH:54][cH:55][c:56]([P:57]([Pd:58]([P:59]([c:60]2[cH:61][cH:62][cH:63][cH:64][cH:65]2)([c:66]2[cH:67][cH:68][cH:69][cH:70][cH:71]2)[c:72]2[cH:73][cH:74][cH:75][cH:76][cH:77]2)([P:78]([c:79]2[cH:80][cH:81][cH:82][cH:83][cH:84]2)([c:85]2[cH:86][cH:87][cH:88][cH:89][cH:90]2)[c:91]2[cH:92][cH:93][cH:94][cH:95][cH:96]2)[P:97]([c:98]2[cH:99][cH:100][cH:101][cH:102][cH:103]2)([c:104]2[cH:105][cH:106][cH:107][cH:108][cH:109]2)[c:110]2[cH:111][cH:112][cH:113][cH:114][cH:115]2)([c:116]2[cH:117][cH:118][cH:119][cH:120][cH:121]2)[c:122]2[cH:123][cH:124][cH:125][cH:126][cH:127]2)[cH:128][cH:129]1.[n:26]1[cH:27][c:28]([B:32]([OH:33])[OH:34])[cH:29][cH:30][cH:31]1>>[F:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[n:9][o:10][c:11](-[c:13]3[cH:14][c:15](-[c:28]4[cH:27][n:26][cH:31][cH:30][cH:29]4)[cH:16][c:17]([F:19])[cH:18]3)[n:12]2)[n:6][cH:7]1
참가 물질출처 및 근거반응 노트

참가 물질

10

반응물 9

HCID 923Sodium Ion2회HCID 8058HexaneHCID 80711,2-DimethoxyethaneHCID 8857Ethyl AcetateHCID 104421,3-PropanediolHCID 19660Carbonate IonHCID 27343783-Pyridinylboronic acid
HCID 10290901
3-(5-Fluoro-2-pyridyl)-5-(3-bromo-5-fluorophenyl)-1,2,4-oxadiazole
HCID 178420554HCID 178420554, 화합물

생성물 1

HCID 101318283-(5-Fluoro-2-pyridyl)-5-(3-fluoro-5-(3-pyridyl)phenyl)-1,2,4-oxadiazole

출처 및 근거

ORD 기록
ord-a9c06b24317b49338091b8aeb66224e0
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI
10.1039/C8SC04228D

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