HRID213399

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID817694

3-Bromo-2-cyanopyridine

C6H3BrN2

HCID154041599

未命名化合物

结构：CC(C)(C)ON=C(c1cc(Br)ccc1O)c1ncccc1Br

HCID154041600

未命名化合物

PRODUCTS

生成物

HCID12005

2,4-Dibromophenol

C6H4Br2O

HCID154041600

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-f9e5e0dd48b244f7a295c2c9913495c5
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

[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]