Dichloromethane → 6-[3-(4-Cyanophenoxy)-2-hydroxy-3-methylbutyl]pyrimidine 1-oxide

HRID 302216

반응식

HRID 302216 반응식
[Cl:1][c:2]1[cH:3][cH:4][cH:5][c:6]([C:7]([O:8][OH:10])=[O:9])[cH:11]1.[Cl:33][CH2:34][Cl:35].[OH:12][CH:13]([C:14]([O:15][c:16]1[cH:17][cH:18][c:19]([C:20]#[N:21])[cH:22][cH:23]1)([CH3:24])[CH3:25])[CH2:26][c:27]1[n:28][cH:29][n:30][cH:31][cH:32]1>>[O-:9][n+:28]1[c:27]([CH2:26][CH:13]([OH:12])[C:14]([O:15][c:16]2[cH:17][cH:18][c:19]([C:20]#[N:21])[cH:22][cH:23]2)([CH3:24])[CH3:25])[cH:32][cH:31][n:30][cH:29]1

참가 물질

4

반응물 3

HCID 6344DichloromethaneHCID 70297m-Chloroperbenzoic acidHCID 198956864-[2-Hydroxy-1,1-dimethyl-3-(4-pyrimidinyl)propoxy]benzonitrile

생성물 1

HCID 198956106-[3-(4-Cyanophenoxy)-2-hydroxy-3-methylbutyl]pyrimidine 1-oxide

출처 및 근거

ORD 기록
ord-22ca6c5a3f1f477b8902f32b1187f21a
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

연결된 노트

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