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Chloride → 4-(2,5-Dibromo-4-hydroxy-3-methoxyphenyl)-3,3-dimethylbutanal

HRID 2334199
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반응식

HRID 2334199 반응식
[Br:34][c:35]1[c:36]([CH2:45][C:46]([CH:47]=[O:48])([CH3:49])[CH3:50])[cH:37][c:38]([Br:44])[c:39]([OH:43])[c:40]1[O:41][CH3:42].[CH2:51]1[O:52][CH2:53][CH2:54][CH2:55]1.[CH3:12][O:13][c:14]1[cH:15][cH:16][cH:17][cH:18][c:19]1[P+:20]([CH3:21])([c:22]1[cH:23][cH:24][cH:25][cH:26][cH:27]1)[c:28]1[cH:29][cH:30][cH:31][cH:32][cH:33]1.[CH3:1][Si:2]([N-:3][Si:4]([CH3:5])([CH3:6])[CH3:7])([CH3:8])[CH3:9].[Cl-:11].[ClH:56].[Li+:10]>>[CH:12](=[O:13])[CH2:47][C:46]([CH2:45][c:36]1[c:35]([Br:34])[c:40]([O:41][CH3:42])[c:39]([OH:43])[c:38]([Br:44])[cH:37]1)([CH3:49])[CH3:50]
참가 물질출처 및 근거반응 노트

참가 물질

8

반응물 7

HCID 312ChlorideHCID 313Hydrochloric AcidHCID 8028TetrahydrofuranHCID 28486Lithium ionHCID 3280088Npc316347HCID 186241923-(2,5-Dibromo-4-hydroxy-3-methoxyphenyl)-2,2-dimethylpropanalHCID 19358685(2-Methoxyphenyl)-methyl-diphenylphosphanium

생성물 1

HCID 186241724-(2,5-Dibromo-4-hydroxy-3-methoxyphenyl)-3,3-dimethylbutanal

출처 및 근거

ORD 기록
ord-9460cffb14954374a6174e4eea05ec5b
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI
10.1039/C8SC04228D

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