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Ethanol → Diethyl 2-dimethylamino-5-phenethylthio-2,4-hexadienedioate

HRID 675309
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인쇄 미리보기

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HRID 675309 반응식
[B-:24]([F:25])([F:26])([F:27])[F:28].[CH2:43]([CH2:44][c:45]1[cH:46][cH:47][cH:48][cH:49][cH:50]1)[S:51][CH2:52][C:53]([O:54][CH2:55][CH3:56])=[O:57].[CH3:1][N:2]([C:3]([C:4](=[S:5])[O:6][CH2:7][CH3:8])=[CH:9][CH:10]=[C:11]([C:12](=[O:13])[O:14][CH2:15][CH3:16])[c:17]1[cH:18][cH:19][cH:20][cH:21][cH:22]1)[CH3:23].[CH3:29][N:30]([CH3:31])[C:32]([C:33]([O:34][CH2:35][CH3:36])=[O:37])=[CH:38][CH:39]=[N+:40]([CH3:41])[CH3:42].[CH3:58][CH2:59][OH:60]>>[CH3:1][N:2]([C:3]([C:4](=[S:5])[O:6][CH2:7][CH3:8])=[CH:9][CH:10]=[C:11]([C:12](=[O:13])[O:14][CH2:15][CH3:16])[CH2:43][CH2:44][c:45]1[cH:46][cH:47][cH:48][cH:49][cH:50]1)[CH3:23]
참가 물질출처 및 근거반응 노트

참가 물질

6

반응물 5

HCID 702EthanolHCID 26255TetrafluoroborateHCID 304016Ethyl (phenethylthio)acetateHCID 86743576[3-(Dimethylamino)-4-ethoxy-4-oxobut-2-enylidene]-dimethylazaniumHCID 86743580Diethyl 2-dimethylamino-5-phenylthio-2,4-hexadienedioate

생성물 1

HCID 86743590Diethyl 2-dimethylamino-5-phenethylthio-2,4-hexadienedioate

출처 및 근거

ORD 기록
ord-20a52e9f87d94801b7e5b3ca5e4c79e5
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI
10.1039/C8SC04228D

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