Chloroform → 5-Chlorosulphonyl-2-(2,2,2-trifluoroethyl)-2-trifluoromethyl-1,3-benzodioxole

반응식

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

참가 물질

반응물 3

HCID 6212Chloroform

HCID 24638Chlorosulfonic acid

HCID 536673032-(2,2,2-Trifluoroethyl)-2-(trifluoromethyl)-1,3-benzodioxole

생성물 1

HCID 189959455-Chlorosulphonyl-2-(2,2,2-trifluoroethyl)-2-trifluoromethyl-1,3-benzodioxole

출처 및 근거

ORD 기록: ord-aecac83063a24de78bd1342a6cbd7831
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D

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