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Dimethylformamide → 2-Acetyl-4-[2-(2,2,2-trifluoroethoxy)-3-tert-butyl-5-methylphenyl]benzo[b]thiophene

HRID 700574
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HRID 700574 반응식
[C:1]([CH3:2])(=[O:3])[c:4]1[cH:5][c:6]2[c:7]([s:8]1)[cH:9][cH:10][cH:11][c:12]2-[c:13]1[c:14]([OH:24])[c:15]([C:20]([CH3:21])([CH3:22])[CH3:23])[cH:16][c:17]([CH3:19])[cH:18]1.[C:31](=[O:32])([O-:33])[O-:34].[C:43]([O:44][CH2:45][CH3:46])(=[O:47])[CH3:48].[CH3:37][CH2:38][CH2:39][CH2:40][CH2:41][CH3:42].[Cs+:35].[Cs+:36].[F:25][C:26]([CH2:27][Br:28])([F:29])[F:30].[O:49]=[CH:50][N:51]([CH3:52])[CH3:53]>>[C:1]([CH3:2])(=[O:3])[c:4]1[cH:5][c:6]2[c:7]([s:8]1)[cH:9][cH:10][cH:11][c:12]2-[c:13]1[c:14]([O:24][CH2:27][C:26]([F:25])([F:29])[F:30])[c:15]([C:20]([CH3:21])([CH3:22])[CH3:23])[cH:16][c:17]([CH3:19])[cH:18]1
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참가 물질

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반응물 7

HCID 6228DimethylformamideHCID 8058HexaneHCID 8857Ethyl AcetateHCID 19660Carbonate IonHCID 678982-Bromo-1,1,1-trifluoroethaneHCID 104967Cesium cation2회HCID 179528022-Acetyl-4-(2-hydroxy-3-tert-butyl-5-methylphenyl)benzo[b]thiophene

생성물 1

HCID 596820732-Acetyl-4-[2-(2,2,2-trifluoroethoxy)-3-tert-butyl-5-methylphenyl]benzo[b]thiophene

출처 및 근거

ORD 기록
ord-deada29863d44efcbdb0d3acebf49be5
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI
10.1039/C8SC04228D

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