HRID2162734

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID19660

Carbonate

CO3-2

HCID31275

1,4-Dioxane

C4H8O2

HCID104967

Cesium(1+)

Cs+

2 次

HCID2737008

1-(difluoromethoxy)-4-iodobenzene

C7H5F2IO

结构：COC(=O)c1cc(COc2ccc(B3OC(C)(C)C(C)(C)O3)cc2)c(C)o1

HCID58824162

未命名化合物

PRODUCTS

生成物

结构：COC(=O)c1cc(COc2ccc(-c3ccc(OC(F)F)cc3)cc2)c(C)o1

HCID58824167

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-020a45d908c8433c90df3e19c1241e43
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

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