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Sodium Ion → tert-Butyl 4-(4-fluoro-5-nitro-2-vinylbenzamido)piperidine-1-carboxylate

HRID 320749
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인쇄 미리보기

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HRID 320749 반응식
[CH2:28]([CH2:29][CH2:39][CH3:40])[O:30][B:31]([CH:32]=[CH2:33])[O:34][CH2:35][CH2:36][CH2:37][CH3:38].[CH2:47]1[O:48][CH2:49][CH2:50][CH2:51]1.[Cl:1][c:2]1[c:3]([C:4](=[O:5])[NH:6][CH:7]2[CH2:8][CH2:9][N:10]([C:13](=[O:14])[O:15][C:16]([CH3:17])([CH3:18])[CH3:19])[CH2:11][CH2:12]2)[cH:20][c:21]([N+:25](=[O:26])[O-:27])[c:22]([F:24])[cH:23]1.[Na+:41].[Na+:42].[O-:43][C:44](=[O:45])[O-:46].[OH2:52].[Pd:53]([Cl:54])[Cl:55].[c:56]1([P:57]([c:58]2[cH:59][cH:60][cH:61][cH:62][cH:63]2)[c:64]2[cH:65][cH:66][cH:67][cH:68][cH:69]2)[cH:70][cH:71][cH:72][cH:73][cH:74]1.[c:75]1([P:76]([c:77]2[cH:78][cH:79][cH:80][cH:81][cH:82]2)[c:83]2[cH:84][cH:85][cH:86][cH:87][cH:88]2)[cH:89][cH:90][cH:91][cH:92][cH:93]1>>[c:2]1([CH:28]=[CH2:29])[c:3]([C:4](=[O:5])[NH:6][CH:7]2[CH2:8][CH2:9][N:10]([C:13](=[O:14])[O:15][C:16]([CH3:17])([CH3:18])[CH3:19])[CH2:11][CH2:12]2)[cH:20][c:21]([N+:25](=[O:26])[O-:27])[c:22]([F:24])[cH:23]1
참가 물질출처 및 근거반응 노트

참가 물질

9

반응물 8

HCID 923Sodium Ion2회HCID 962WaterHCID 8028TetrahydrofuranHCID 11776Triphenylphosphine2회HCID 19660Carbonate IonHCID 24290Palladium ChlorideHCID 236543Dibutyl Vinylboronate (stabilized with Phenothiazine)
HCID 67167954
tert-Butyl 4-(2-chloro-4-fluoro-5-nitrobenzamido)piperidine-1-carboxylate

생성물 1

HCID 86653322tert-Butyl 4-(4-fluoro-5-nitro-2-vinylbenzamido)piperidine-1-carboxylate

출처 및 근거

ORD 기록
ord-ff56940678994ae48d2a8229f0d10848
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI
10.1039/C8SC04228D

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