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Ethylene Glycol → 1h-Indole-1-carboxylic acid,5-(2-methyl-1,3-dioxolan-2-yl)-,1,1-dimethylethyl ester

HRID 690138
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HRID 690138 반응식
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[n:8]1[cH:9][cH:10][c:11]2[cH:12][c:13]([C:17]([CH3:18])=[O:19])[cH:14][cH:15][c:16]12.[Na+:45].[O-:41][C:42]([OH:43])=[O:44].[OH:20][CH2:21][CH2:22][OH:23].[c:24]1([CH3:25])[cH:26][cH:27][c:28]([S:29]([O-:30])(=[O:31])=[O:32])[cH:33][cH:34]1.[cH:46]1[cH:47][cH:48][cH:49][cH:50][cH:51]1.[nH+:35]1[cH:36][cH:37][cH:38][cH:39][cH:40]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[n:8]1[cH:9][cH:10][c:11]2[cH:12][c:13]([C:17]3([CH3:18])[O:19][CH2:22][CH2:21][O:20]3)[cH:14][cH:15][c:16]12
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반응물 7

HCID 174Ethylene GlycolHCID 241BenzeneHCID 769Bicarbonate IonHCID 923Sodium IonHCID 85570p-ToluenesulfonateHCID 4989215PyridiniumHCID 57637401tert-Butyl 5-acetyl-1H-indole-1-carboxylate

생성물 1

HCID 57637304
1h-Indole-1-carboxylic acid,5-(2-methyl-1,3-dioxolan-2-yl)-,1,1-dimethylethyl ester

출처 및 근거

ORD 기록
ord-6e270de3ce7240658e4a33b94575aca4
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI
10.1039/C8SC04228D

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