HRID2345909

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID175

Acetate

C2H3O2-

2 次

HCID962

Water

H2O

HCID1140

Toluene

C7H8

HCID6344

Dichloromethane

CH2Cl2

HCID75806

Phosphine, tricyclohexyl-

C18H33P

HCID105144

Palladium(2+)

Pd+2

HCID2734389

4-(Trifluoromethyl)phenylboronic acid

C7H6BF3O2

HCID16638330

5-Iodopyridazin-3(2H)-one

C4H3IN2O

PRODUCTS

生成物

HCID57950387

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-03db922956964ddcbd54bdb9562f1d56
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (10/10)

反应 SMILES

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