Toluene → 6-Benzenesulfonyl-1-chloro-1,2,3,4-tetrahydro-naphthalene

반응식

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

참가 물질

반응물 3

HCID 1140Toluene

HCID 24386Thionyl Chloride

HCID 575267796-Benzenesulfonyl-1,2,3,4-tetrahydro-naphthalen-1-ol

생성물 1

HCID 575267806-Benzenesulfonyl-1-chloro-1,2,3,4-tetrahydro-naphthalene

출처 및 근거

ORD 기록: ord-27cebff47ae64ab48a2c41fe3a707f1c
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D

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