Dichloromethane → Ethyl 3-[4-(4-chlorosulfonylphenoxy)-3,5-difluorophenyl]-2-methylprop-2-enoate

반응식

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

참가 물질

반응물 3

HCID 6344Dichloromethane

HCID 24638Chlorosulfonic acid

HCID 77943207Ethyl 3-(3,5-difluoro-4-phenoxyphenyl)-2-methylprop-2-enoate

생성물 1

HCID 91074155Ethyl 3-[4-(4-chlorosulfonylphenoxy)-3,5-difluorophenyl]-2-methylprop-2-enoate

출처 및 근거

ORD 기록: ord-1f963f7e2ec7442fba88d926a6a2355c
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D

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