3,5-Dichlorobenzylic alcohol → 2-(3,5-Dichlorobenzyloxy)-4-(2,4-dichlorophenyl)-5-(4-chlorophenyl)pyrimidine

반응식

[CH3:1][S:2][c:3]1[n:4][cH:5][c:6](-[c:17]2[cH:18][cH:19][c:20]([Cl:23])[cH:21][cH:22]2)[c:7](-[c:9]2[c:10]([Cl:16])[cH:11][c:12]([Cl:15])[cH:13][cH:14]2)[n:8]1.[Cl:24][c:25]1[cH:26][c:27]([CH2:28][OH:29])[cH:30][c:31]([Cl:33])[cH:32]1>>[c:3]1([O:29][CH2:28][c:27]2[cH:26][c:25]([Cl:24])[cH:32][c:31]([Cl:33])[cH:30]2)[n:4][cH:5][c:6](-[c:17]2[cH:18][cH:19][c:20]([Cl:23])[cH:21][cH:22]2)[c:7](-[c:9]2[c:10]([Cl:16])[cH:11][c:12]([Cl:15])[cH:13][cH:14]2)[n:8]1

참가 물질

반응물 2

HCID 432363,5-Dichlorobenzylic alcohol

HCID 597539142-Methylthio-4-(2,4-dichlorophenyl)-5-(4-chlorophenyl)pyrimidine

생성물 1

HCID 597539452-(3,5-Dichlorobenzyloxy)-4-(2,4-dichlorophenyl)-5-(4-chlorophenyl)pyrimidine

출처 및 근거

ORD 기록: ord-54bf83f2798040b39bcf982895928978
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D

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