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Carbonate Ion → 4-Methyl-2-(3-trimethylsilanyl-phenyl)-pyridine

HRID 294420
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HRID 294420 반응식
[Br:14][c:15]1[n:16][cH:17][cH:18][c:19]([CH3:21])[cH:20]1.[C:22](=[O:23])([O-:24])[O-:25].[C:28]([P:29]([C:30]([CH3:31])([CH3:32])[CH3:33])[C:34]([CH3:35])([CH3:36])[CH3:37])([CH3:38])([CH3:39])[CH3:40].[CH3:1][Si:2]([c:3]1[cH:4][c:5]([B:9]([OH:10])[OH:11])[cH:6][cH:7][cH:8]1)([CH3:12])[CH3:13].[CH:43](=[CH:44][C:45]([CH:46]=[CH:47][c:48]1[cH:49][cH:50][cH:51][cH:52][cH:53]1)=[O:54])[c:55]1[cH:56][cH:57][cH:58][cH:59][cH:60]1.[CH:61](=[CH:62][C:63]([CH:64]=[CH:65][c:66]1[cH:67][cH:68][cH:69][cH:70][cH:71]1)=[O:72])[c:73]1[cH:74][cH:75][cH:76][cH:77][cH:78]1.[CH:79](=[CH:80][C:81]([CH:82]=[CH:83][c:84]1[cH:85][cH:86][cH:87][cH:88][cH:89]1)=[O:90])[c:91]1[cH:92][cH:93][cH:94][cH:95][cH:96]1.[Cs+:26].[Cs+:27].[O:97]1[CH2:98][CH2:99][O:100][CH2:101][CH2:102]1.[Pd:41].[Pd:42]>>[CH3:1][Si:2]([c:3]1[cH:4][c:5](-[c:15]2[n:16][cH:17][cH:18][c:19]([CH3:21])[cH:20]2)[cH:6][cH:7][cH:8]1)([CH3:12])[CH3:13]
참가 물질출처 및 근거반응 노트

참가 물질

9

반응물 8

HCID 19660Carbonate IonHCID 23938Palladium2회HCID 312751,4-DioxaneHCID 83681Tris(1,1-dimethylethyl)phosphineHCID 95417Dibenzylidene acetone3회HCID 104967Cesium cation2회HCID 27340872-Bromo-4-methylpyridine
HCID 4577181
3-(Trimethylsilyl)phenylboronic acid

생성물 1

HCID 592113504-Methyl-2-(3-trimethylsilanyl-phenyl)-pyridine

출처 및 근거

ORD 기록
ord-adb62f581f3e4bbeb19cb14dfa5984cf
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI
10.1039/C8SC04228D

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