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Benzene → 2,2-Dimethyl-3-(2,2-dichlorovinyl)-cyclopropanecarboxylic acid-3-(phenoxy)-alpha-vinylbenzyl ester

HRID 156073
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HRID 156073 반응식
[CH3:25][C:26]1([CH3:36])[CH:27]([C:33](=[O:34])[OH:35])[CH:28]1[CH:29]=[C:30]([Cl:31])[Cl:32].[Cl-:24].[O:7]([c:8]1[cH:9][cH:10][cH:11][cH:12][cH:13]1)[c:14]1[cH:15][c:16]([CH:17]([CH:18]=[CH2:19])[OH:20])[cH:21][cH:22][cH:23]1.[OH2:43].[cH:1]1[cH:2][cH:3][n:4][cH:5][cH:6]1.[cH:37]1[cH:38][cH:39][cH:40][cH:41][cH:42]1>>[O:7]([c:8]1[cH:9][cH:10][cH:11][cH:12][cH:13]1)[c:14]1[cH:15][c:16]([CH:17]([CH:18]=[CH2:19])[O:20][C:33]([CH:27]2[C:26]([CH3:25])([CH3:36])[CH:28]2[CH:29]=[C:30]([Cl:31])[Cl:32])=[O:34])[cH:21][cH:22][cH:23]1
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7

반응물 6

HCID 241BenzeneHCID 312ChlorideHCID 962WaterHCID 1049PyridineHCID 91658Permethric acidHCID 129613931-(3-Phenoxyphenyl)prop-2-en-1-ol

생성물 1

HCID 12961392
2,2-Dimethyl-3-(2,2-dichlorovinyl)-cyclopropanecarboxylic acid-3-(phenoxy)-alpha-vinylbenzyl ester

출처 및 근거

ORD 기록
ord-42e5857c4f11410688eebf27a12a9341
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI
10.1039/C8SC04228D

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