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Methanol → 4-[3,5-Difluoro-4-(methylsulfonyl)phenyl]-3-phenylfuran-2(5h)-one

HRID 311359
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HRID 311359 반응식
[C:30]([O:31][O-:32])(=[O:33])[c:34]1[c:35]([C:40]([O-:41])=[O:42])[cH:36][cH:37][cH:38][cH:39]1.[CH3:47][OH:48].[Cl:44][CH2:45][Cl:46].[F:1][c:2]1[cH:3][c:4]([C:11]2=[C:12]([c:17]3[cH:18][cH:19][cH:20][cH:21][cH:22]3)[C:13](=[O:16])[O:14][CH2:15]2)[cH:5][c:6]([F:10])[c:7]1[S:8][CH3:9].[Mg+2:43].[OH2:23].[OH2:24].[OH2:25].[OH2:26].[OH2:27].[OH2:28].[OH2:29]>>[F:1][c:2]1[cH:3][c:4]([C:11]2=[C:12]([c:17]3[cH:18][cH:19][cH:20][cH:21][cH:22]3)[C:13](=[O:16])[O:14][CH2:15]2)[cH:5][c:6]([F:10])[c:7]1[S:8]([CH3:9])(=[O:23])=[O:24]
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HCID 887MethanolHCID 888Magnesium CationHCID 962Water7회HCID 6344DichloromethaneHCID 227466594-[3,5-difluoro-4-(methylthio)-phenyl]-3-phenylfuran-2(5H)-oneHCID 714406072-Oxidooxycarbonylbenzoate

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HCID 9968254
4-[3,5-Difluoro-4-(methylsulfonyl)phenyl]-3-phenylfuran-2(5h)-one

출처 및 근거

ORD 기록
ord-eb713cb2506c4addab8f9e9077a8b3a2
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI
10.1039/C8SC04228D

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