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Chloride → 2-(2,4-Dichlorophenyl)-butendioic acid diethyl ester

HRID 1233318
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HRID 1233318 반응식
[CH2:27]([O:28][CH2:29][CH3:30])[CH3:31].[CH2:2]([Br:3])[CH3:4].[Cl-:37].[Cl-:39].[Cl:5][c:6]1[cH:7][c:8]([Cl:13])[c:9]([I:12])[cH:10][cH:11]1.[I:14][C:15]([C:16](=[O:17])[O:18][CH2:19][CH3:20])=[CH:21][C:22](=[O:23])[O:24][CH2:25][CH3:26].[Mg:1].[O:32]=[CH:33][N:34]([CH3:35])[CH3:36].[Pd:59]([Cl:60])[Cl:61].[Zn+2:38].[c:40]1([P:41]([c:42]2[cH:43][cH:44][cH:45][cH:46][cH:47]2)[c:48]2[cH:49][cH:50][cH:51][cH:52][cH:53]2)[cH:54][cH:55][cH:56][cH:57][cH:58]1>>[Cl:5][c:6]1[cH:7][c:8]([Cl:13])[c:9]([C:15]([C:16](=[O:17])[O:18][CH2:19][CH3:20])=[CH:21][C:22](=[O:23])[O:24][CH2:25][CH3:26])[cH:10][cH:11]1
참가 물질출처 및 근거반응 노트

참가 물질

11

반응물 10

HCID 312Chloride2회HCID 3283Diethyl EtherHCID 6228DimethylformamideHCID 6332Ethyl BromideHCID 11776TriphenylphosphineHCID 24290Palladium ChlorideHCID 32051Zinc(2+)HCID 96864
2,4-Dichloro-1-iodobenzene
HCID 181578Diethyl 2-iodobut-2-enedioate
HCID 5462224Magnesium

생성물 1

HCID 536848672-(2,4-Dichlorophenyl)-butendioic acid diethyl ester

출처 및 근거

ORD 기록
ord-a748f58de5bc4471b8f6eaba315129fc
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI
10.1039/C8SC04228D

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