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Potassium Cation → (+/-)-[4-(2-Methylphenyl)-2,3-dihydro-1-benzofuran-2-yl]methyl 4-methylbenzenesulfonate

HRID 105456
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HRID 105456 반응식
[C:33](=[O:34])([O-:35])[O-:36].[CH3:1][c:2]1[cH:3][cH:4][c:5]([S:8](=[O:9])(=[O:10])[O:11][CH2:12][CH:13]2[O:14][c:15]3[c:16]([c:18]([Br:22])[cH:19][cH:20][cH:21]3)[CH2:17]2)[cH:6][cH:7]1.[CH3:23][c:24]1[c:25]([B:30]([OH:31])[OH:32])[cH:26][cH:27][cH:28][cH:29]1.[K+:37].[K+:38]>>[CH3:1][c:2]1[cH:3][cH:4][c:5]([S:8](=[O:9])(=[O:10])[O:11][CH2:12][CH:13]2[O:14][c:15]3[c:16]([c:18](-[c:25]4[c:24]([CH3:23])[cH:29][cH:28][cH:27][cH:26]4)[cH:19][cH:20][cH:21]3)[CH2:17]2)[cH:6][cH:7]1
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반응물 4

HCID 813Potassium Cation2회HCID 19660Carbonate IonHCID 27332672-Methylphenyl boronic acidHCID 86599073(+/-)-(4-Bromo-2,3-dihydro-1-benzofuran-2-yl)methyl 4-methylbenzenesulfonate

생성물 1

HCID 86599075(+/-)-[4-(2-Methylphenyl)-2,3-dihydro-1-benzofuran-2-yl]methyl 4-methylbenzenesulfonate

출처 및 근거

ORD 기록
ord-8cf66a06b1ff4a20ac99db208ddbf58d
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI
10.1039/C8SC04228D

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