Benzene → 2-(4,4'-Difluorobenzhydrylidene)-1,3,5-trithiane

반응식

[F:1][c:2]1[cH:3][cH:4][c:5]([C:8]([CH:9]2[S:10][CH2:11][S:12][CH2:13][S:14]2)([OH:15])[c:16]2[cH:17][cH:18][c:19]([F:22])[cH:20][cH:21]2)[cH:6][cH:7]1.[c:23]1([CH3:24])[cH:25][cH:26][c:27]([S:28]([OH:29])(=[O:30])=[O:31])[cH:32][cH:33]1.[cH:34]1[cH:35][cH:36][cH:37][cH:38][cH:39]1>>[F:1][c:2]1[cH:3][cH:4][c:5]([C:8](=[C:9]2[S:10][CH2:11][S:12][CH2:13][S:14]2)[c:16]2[cH:17][cH:18][c:19]([F:22])[cH:20][cH:21]2)[cH:6][cH:7]1

참가 물질

반응물 3

HCID 241Benzene

HCID 6101p-Toluenesulfonic acid

HCID 143292582-{Bis(4-fluorophenyl)hydroxymethyl}-1,3,5-trithiane

생성물 1

HCID 143292842-(4,4'-Difluorobenzhydrylidene)-1,3,5-trithiane

출처 및 근거

ORD 기록: ord-9b74a83567bd484c813276e355f61462
출처 데이터셋: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D

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