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Bicarbonate Ion → 2-(2,4-Dichloro-6-methylphenoxy)-7-(1-ethylpropyl)-1-methyl-4-(trifluoromethyl)-1H-benzimidazole

HRID 2144663
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HRID 2144663 반응식
[C:31](=[O:32])([O-:33])[O-:34].[C:37](=[O:38])([OH:39])[O-:40].[CH3:42][N:43]([CH3:44])[CH:45]=[O:46].[Cl:1][c:2]1[n:3][c:4]2[c:5]([n:6]1[CH3:7])[c:8]([CH:16]([CH2:17][CH3:18])[CH2:19][CH3:20])[cH:9][cH:10][c:11]2[C:12]([F:13])([F:14])[F:15].[Cl:21][c:22]1[cH:23][c:24]([CH3:30])[c:25]([OH:29])[c:26]([Cl:28])[cH:27]1.[K+:35].[K+:36].[Na+:41]>>[c:2]1([O:29][c:25]2[c:24]([CH3:30])[cH:23][c:22]([Cl:21])[cH:27][c:26]2[Cl:28])[n:3][c:4]2[c:5]([n:6]1[CH3:7])[c:8]([CH:16]([CH2:17][CH3:18])[CH2:19][CH3:20])[cH:9][cH:10][c:11]2[C:12]([F:13])([F:14])[F:15]
참가 물질출처 및 근거반응 노트

참가 물질

8

반응물 7

HCID 769Bicarbonate IonHCID 813Potassium Cation2회HCID 923Sodium IonHCID 6228DimethylformamideHCID 152922,4-Dichloro-6-methylphenolHCID 19660Carbonate IonHCID 672728702-Chloro-7-(1-ethylpropyl)-1-methyl-4-(trifluoromethyl)-1H-benzimidazole

생성물 1

HCID 580123642-(2,4-Dichloro-6-methylphenoxy)-7-(1-ethylpropyl)-1-methyl-4-(trifluoromethyl)-1H-benzimidazole

출처 및 근거

ORD 기록
ord-9598013376024aadaaa9ab9919c63da4
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI
10.1039/C8SC04228D

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