2-(3-Chloro-5-hydroxyphenyl)acetic acid → {3-Chloro-5-[2-chloro-4-(phenylsulfonyl)phenoxy]phenyl}acetic acid

반응식

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

참가 물질

반응물 2

HCID 596446192-(3-Chloro-5-hydroxyphenyl)acetic acid

HCID 689525093-Chloro-4-fluorophenyl phenyl sulfone

생성물 1

HCID 16123207{3-Chloro-5-[2-chloro-4-(phenylsulfonyl)phenoxy]phenyl}acetic acid

출처 및 근거

ORD 기록: ord-20ae67b4be074279b39c897edff3cd0b
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D

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