HRID2155831

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID934

Nickel cation

Ni+2

HCID962

Water

H2O

HCID1140

Toluene

C7H8

HCID8028

Tetrahydrofuran

C4H8O

HCID13035313

未命名化合物

结构：ClC(Cl)(CCP(c1ccccc1)c1ccccc1)P(c1ccccc1)c1ccccc1

HCID19755961

未命名化合物

HCID178418332

未命名化合物

PRODUCTS

生成物

HCID19868176

6-Fluoro-2,5-dimethylquinoline

C11H10FN

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-f56968743f1e42d3a329f1e15d8c4d04
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (4/10)

反应 SMILES

[Br:1][c:2]1[c:3]2[cH:4][cH:5][c:6]([CH3:13])[n:7][c:8]2[cH:9][cH:10][c:11]1[F:12].[CH3:14][Mg:15][Cl:16].[CH3:50][c:51]1[cH:52][cH:53][cH:54][cH:55][cH:56]1.[Cl:19][C:20]([Cl:21])([P:22]([c:23]1[cH:24][cH:25][cH:26][cH:27][cH:28]1)[c:29]1[cH:30][cH:31][cH:32][cH:33][cH:34]1)[CH2:35][CH2:36][P:37]([c:38]1[cH:39][cH:40][cH:41][cH:42][cH:43]1)[c:44]1[cH:45][cH:46][cH:47][cH:48][cH:49]1.[Ni+2:18].[O:57]1[CH2:58][CH2:59][CH2:60][CH2:61]1.[OH2:17]>>[c:2]1([CH3:14])[c:3]2[cH:4][cH:5][c:6]([CH3:13])[n:7][c:8]2[cH:9][cH:10][c:11]1[F:12]