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Potassium Cation → 2-(1-(2,5-Dichloroquinolin-3-yl)ethyl)isoindoline-1,3-dione

HRID 104013
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HRID 104013 반응식
[Cl:1][c:2]1[n:3][c:4]2[cH:5][cH:6][cH:7][c:8]([Cl:15])[c:9]2[cH:10][c:11]1[CH:12]([CH3:13])[OH:14].[Cl:20][c:21]1[c:22]([CH:23]([Cl:24])[CH3:25])[cH:26][c:27]2[c:28]([cH:29][cH:30][cH:31][c:32]2[Cl:33])[n:34]1.[Cl:57][CH2:58][Cl:59].[K+:46].[K+:47].[O-:48][C:49]([O-:50])=[O:51].[O:35]=[C:36]1[NH:37][C:38](=[O:39])[c:40]2[cH:41][cH:42][cH:43][cH:44][c:45]21.[O:52]=[CH:53][N:54]([CH3:55])[CH3:56].[S:16]([Cl:17])([Cl:18])=[O:19]>>[Cl:1][c:2]1[n:3][c:4]2[cH:5][cH:6][cH:7][c:8]([Cl:15])[c:9]2[cH:10][c:11]1[CH:12]([CH3:13])[N:37]1[C:36](=[O:35])[c:45]2[c:40]([cH:41][cH:42][cH:43][cH:44]2)[C:38]1=[O:39]
참가 물질출처 및 근거반응 노트

참가 물질

9

반응물 8

HCID 813Potassium Cation2회HCID 6228DimethylformamideHCID 6344DichloromethaneHCID 6809PhthalimideHCID 19660Carbonate IonHCID 24386Thionyl ChlorideHCID 577079561-(2,5-Dichloroquinolin-3-yl)ethanol
HCID 57708055
2,5-Dichloro-3-(1-chloroethyl)quinoline

생성물 1

HCID 577078732-(1-(2,5-Dichloroquinolin-3-yl)ethyl)isoindoline-1,3-dione

출처 및 근거

ORD 기록
ord-32cb0a0168704241bd0cbe2afda784b3
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI
10.1039/C8SC04228D

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