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Ethanol → Methyl 4-(((benzyloxy)carbonyl)amino)-5-bromo-2-(4-chlorophenyl)thiophene-3-carboxylate

HRID 1206510
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인쇄 미리보기

반응식

HRID 1206510 반응식
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][C:9](=[O:10])[NH:11][c:12]1[c:13]([C:19](=[O:20])[O:21][CH3:22])[c:14]([Br:18])[s:15][c:16]1[Br:17].[CH2:47]([OH:48])[CH3:49].[Cl:23][c:24]1[cH:25][cH:26][c:27]([B:30]([OH:31])[OH:32])[cH:28][cH:29]1.[Na+:33].[Na+:34].[O-:35][C:36](=[O:37])[O-:38].[OH2:46].[c:39]1([CH3:40])[cH:41][cH:42][cH:43][cH:44][cH:45]1>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][C:9](=[O:10])[NH:11][c:12]1[c:13]([C:19](=[O:20])[O:21][CH3:22])[c:14](-[c:27]2[cH:26][cH:25][c:24]([Cl:23])[cH:29][cH:28]2)[s:15][c:16]1[Br:17]
참가 물질출처 및 근거반응 노트

참가 물질

8

반응물 7

HCID 702EthanolHCID 923Sodium Ion2회HCID 962WaterHCID 1140TolueneHCID 19660Carbonate IonHCID 742994-Chlorophenylboronic acidHCID 58191482Methyl 4-(((benzyloxy)carbonyl)amino)-2,5-dibromothiophene-3-carboxylate

생성물 1

HCID 58191687Methyl 4-(((benzyloxy)carbonyl)amino)-5-bromo-2-(4-chlorophenyl)thiophene-3-carboxylate

출처 및 근거

ORD 기록
ord-b4d790ef3f004ec8820a0cac9546a852
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI
10.1039/C8SC04228D

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