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Bromide ion → 3-[(3,4-dichlorophenyl)methyl]-2-(1-methylethyl)-3,5,6,7-tetrahydro-4H-benzimidazol-4-one

HRID 1549016
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인쇄 미리보기

반응식

HRID 1549016 반응식
[Br-:26].[Br:14][CH2:15][c:16]1[cH:17][c:18]([Cl:23])[c:19]([Cl:22])[cH:20][cH:21]1.[CH3:1][CH:2]([CH3:3])[c:4]1[n:5][c:6]2[c:7]([nH:8]1)[CH2:9][CH2:10][CH2:11][C:12]2=[O:13].[CH3:27][CH2:28][CH2:29][CH2:30][N+:31]([CH2:32][CH2:33][CH2:34][CH3:35])([CH2:36][CH2:37][CH2:38][CH3:39])[CH2:40][CH2:41][CH2:42][CH3:43].[CH3:44][c:45]1[cH:46][cH:47][cH:48][cH:49][cH:50]1.[Na+:25].[OH-:24]>>[CH3:1][CH:2]([CH3:3])[c:4]1[n:5]([CH2:15][c:16]2[cH:17][c:18]([Cl:23])[c:19]([Cl:22])[cH:20][cH:21]2)[c:6]2[c:7]([n:8]1)[CH2:9][CH2:10][CH2:11][C:12]2=[O:13]
참가 물질출처 및 근거반응 노트

참가 물질

8

반응물 7

HCID 259Bromide ionHCID 923Sodium IonHCID 961HydroxideHCID 1140TolueneHCID 16028TetrabutylammoniumHCID 6397264-(Bromomethyl)-1,2-dichlorobenzeneHCID 584601782-Isopropyl-5,6-dihydro-1H-benzo[d]imidazol-7(4H)-one

생성물 1

HCID 584601653-[(3,4-dichlorophenyl)methyl]-2-(1-methylethyl)-3,5,6,7-tetrahydro-4H-benzimidazol-4-one

출처 및 근거

ORD 기록
ord-4d500f24ed8649b7acc27258e796f2f5
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI
10.1039/C8SC04228D

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