HRID210814

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID962

Water

H2O

HCID19660

Carbonate

CO3-2

HCID31275

1,4-Dioxane

C4H8O2

HCID104967

Cesium(1+)

Cs+

2 次

HCID7010733

2-IODO-5-METHOXYPYRIDINE

C6H6INO

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)cn3)cc2)c(C)o1

HCID58824205

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-4ae128af7b3040e79481117348047b7f
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

[C:28](=[O:29])([O-:30])[O-:31].[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.[ClH:44].[Cs+:32].[Cs+:33].[I:34][c:35]1[n:36][cH:37][c:38]([O:41][CH3:42])[cH:39][cH:40]1.[O:43].[O:45]1[CH2:46][CH2:47][O:48][CH2:49][CH2:50]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:35]3[n:36][cH:37][c:38]([O:41][CH3:42])[cH:39][cH:40]3)[cH:16][cH:17]2)[cH:9]1