Water → Ethyl 3-(2-chloro-4,5-difluorophenyl)-3-oxopropanoate

반응식

[Cl:1][c:2]1[c:3]([C:4](=[O:5])[CH:6]([C:7](=[O:8])[O:9][CH2:10][CH3:11])[C:12]([O:13][CH2:14][CH3:15])=[O:16])[cH:17][c:18]([F:22])[c:19]([F:21])[cH:20]1.[OH2:34].[c:23]1([CH3:24])[cH:25][cH:26][c:27]([S:28]([OH:29])(=[O:30])=[O:31])[cH:32][cH:33]1>>[Cl:1][c:2]1[c:3]([C:4](=[O:5])[CH2:6][C:7](=[O:8])[O:9][CH2:10][CH3:11])[cH:17][c:18]([F:22])[c:19]([F:21])[cH:20]1

참가 물질

반응물 3

HCID 962Water

HCID 6101p-Toluenesulfonic acid

HCID 14425827Diethyl (2-chloro-4,5-difluorobenzoyl)propanedioate

생성물 1

HCID 14423850Ethyl 3-(2-chloro-4,5-difluorophenyl)-3-oxopropanoate

출처 및 근거

ORD 기록: ord-84209634994c48cbbb946bd208ad6e7b
출처 데이터셋: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D

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