3-Bromopyridine-2-carbonitrile → 2,4-Dibromophenol

HRID 213399

반응식

HRID 213399 반응식
[Br:1][c:2]1[c:3]([C:4]#[N:5])[n:6][cH:7][cH:8][cH:9]1.[C:10]([O:11][N:12]=[C:13]([c:14]1[cH:15][cH:16][cH:25][cH:26][n:27]1)[c:17]1[c:18]([OH:24])[cH:19][cH:20][c:21]([Br:23])[cH:22]1)([CH3:28])([CH3:29])[CH3:30].[C:31]([CH3:32])([CH3:33])([CH3:34])[O:35][N:36]=[C:37]([c:38]1[c:39]([OH:45])[cH:40][cH:41][c:42]([Br:44])[cH:43]1)[c:46]1[n:47][cH:48][cH:49][cH:50][c:51]1[Br:52]>>[Br:1][c:17]1[c:18]([OH:24])[cH:19][cH:20][c:21]([Br:23])[cH:22]1.[C:31]([CH3:32])([CH3:33])([CH3:34])[O:35][N:36]=[C:37]([c:38]1[c:39]([OH:45])[cH:40][cH:41][c:42]([Br:44])[cH:43]1)[c:46]1[n:47][cH:48][cH:49][cH:50][c:51]1[Br:52]

참가 물질

5

반응물 3

HCID 8176943-Bromopyridine-2-carbonitrileHCID 154041599HCID 154041599, 화합물HCID 154041600HCID 154041600, 화합물

생성물 2

HCID 120052,4-DibromophenolHCID 154041600HCID 154041600, 화합물

출처 및 근거

ORD 기록
ord-f9e5e0dd48b244f7a295c2c9913495c5
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

연결된 노트

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