Dichloromethane → 4-Methoxy-3-[4-(2,2,2-trifluoro-acetyl)-piperazin-1-yl]-benzenesulfonyl chloride

반응식

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

참가 물질

반응물 3

HCID 6344Dichloromethane

HCID 24638Chlorosulfonic acid

HCID 37881442,2,2-Trifluoro-1-[4-(2-methoxyphenyl)piperazin-1-yl]ethanone

생성물 1

HCID 121366554-Methoxy-3-[4-(2,2,2-trifluoro-acetyl)-piperazin-1-yl]-benzenesulfonyl chloride

출처 및 근거

ORD 기록: ord-4facbcd71b494f19bb392538e951eeb3
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D

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