Methanol → 4-Chloro-6-[2-(2,4-dichloro-phenyl)-ethylamino]-pyrimidine-2-carbaldehyde

반응식

[CH3:23][OH:24].[Cl:1][c:2]1[n:3][c:4]([CH:19]([CH2:20][OH:21])[OH:22])[n:5][c:6]([NH:8][CH2:9][CH2:10][c:11]2[c:12]([Cl:18])[cH:13][c:14]([Cl:17])[cH:15][cH:16]2)[cH:7]1.[OH2:25]>>[Cl:1][c:2]1[n:3][c:4]([CH:19]=[O:22])[n:5][c:6]([NH:8][CH2:9][CH2:10][c:11]2[c:12]([Cl:18])[cH:13][c:14]([Cl:17])[cH:15][cH:16]2)[cH:7]1

참가 물질

반응물 3

HCID 887Methanol

HCID 962Water

HCID 866157091-{4-Chloro-6-[2-(2,4-dichloro-phenyl)-ethylamino]-pyrimidin-2-yl}-ethane-1,2-diol

생성물 1

HCID 866157104-Chloro-6-[2-(2,4-dichloro-phenyl)-ethylamino]-pyrimidine-2-carbaldehyde

출처 및 근거

ORD 기록: ord-4fc45553c4a540f49bd744574c103d6a
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D

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