2,4-Dichloroaniline → 5-Pyrimidinecarboxylic acid, 2-[(2,4-dichlorophenyl)amino]-4-(trifluoromethyl)-, methyl ester

반응식

[Cl:1][c:2]1[n:3][cH:4][c:5]([C:12](=[O:13])[O:14][CH3:15])[c:6]([C:8]([F:9])([F:10])[F:11])[n:7]1.[NH2:16][c:17]1[cH:18][cH:19][c:20]([Cl:21])[cH:22][c:23]1[Cl:24].[O:25]1[CH2:26][CH2:27][O:28][CH2:29][CH2:30]1>>[c:2]1([NH:16][c:17]2[cH:18][cH:19][c:20]([Cl:21])[cH:22][c:23]2[Cl:24])[n:3][cH:4][c:5]([C:12](=[O:13])[O:14][CH3:15])[c:6]([C:8]([F:9])([F:10])[F:11])[n:7]1

참가 물질

반응물 3

HCID 111232,4-Dichloroaniline

HCID 312751,4-Dioxane

HCID 3696469Methyl 2-chloro-4-(trifluoromethyl)pyrimidine-5-carboxylate

생성물 1

HCID 167195495-Pyrimidinecarboxylic acid, 2-[(2,4-dichlorophenyl)amino]-4-(trifluoromethyl)-, methyl ester

출처 및 근거

ORD 기록: ord-1b7bfb24c10e4f11b325da12e4c48078
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D

반응 노트

불러오는 중…