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3,4-Difluorophenol → 2-(3,4-Difluorophenoxy)-4-cyclohexyloxy-5-(4-chlorophenyl)-6-(2,4-dichlorophenyl)pyrimidine

HRID 284147
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인쇄 미리보기

반응식

HRID 284147 반응식
[CH2:33]([Li:34])[CH2:35][CH2:36][CH3:37].[CH3:1][S:2](=[O:3])(=[O:4])[c:5]1[n:6][c:7](-[c:25]2[c:26]([Cl:32])[cH:27][c:28]([Cl:31])[cH:29][cH:30]2)[c:8](-[c:18]2[cH:19][cH:20][c:21]([Cl:24])[cH:22][cH:23]2)[c:9]([O:11][CH:12]2[CH2:13][CH2:14][CH2:15][CH2:16][CH2:17]2)[n:10]1.[F:38][c:39]1[cH:40][c:41]([OH:46])[cH:42][cH:43][c:44]1[F:45]>>[c:5]1([O:46][c:41]2[cH:40][c:39]([F:38])[c:44]([F:45])[cH:43][cH:42]2)[n:6][c:7](-[c:25]2[c:26]([Cl:32])[cH:27][c:28]([Cl:31])[cH:29][cH:30]2)[c:8](-[c:18]2[cH:19][cH:20][c:21]([Cl:24])[cH:22][cH:23]2)[c:9]([O:11][CH:12]2[CH2:13][CH2:14][CH2:15][CH2:16][CH2:17]2)[n:10]1
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참가 물질

4

반응물 3

HCID 759273,4-DifluorophenolHCID 691979992-(Methylsulfonyl)-4-(cyclohexyloxy)-5-(4-chlorophenyl)-6-(2,4-dichlorophenyl)pyrimidineHCID 178418339Butyllithium

생성물 1

HCID 103255242-(3,4-Difluorophenoxy)-4-cyclohexyloxy-5-(4-chlorophenyl)-6-(2,4-dichlorophenyl)pyrimidine

출처 및 근거

ORD 기록
ord-4867ccaa5dfd4ad5be7b0ebaae1d76b8
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI
10.1039/C8SC04228D

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