HRID192425

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

2 次

HCID19660

Carbonate

CO3-2

HCID31275

1,4-Dioxane

C4H8O2

HCID66827

Boronic acid, phenyl-

C6H7BO2

HCID22327474

1-(Bromomethyl)-4-chloro-2-methoxybenzene

C8H8BrClO

结构：c1ccc([PH](c2ccccc2)(c2ccccc2)[Pd]([PH](c2ccccc2)(c2ccccc2)c2ccccc2)([PH](c2ccccc2)(c2ccccc2)c2ccccc2)[PH](c2ccccc2)(c2ccccc2)c2ccccc2)cc1

HCID178420554

未命名化合物

PRODUCTS

生成物

HCID69216710

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-1ef0a798d59e4a519b6c5f2a30f6a942
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][CH2:2][c:3]1[c:4]([O:10][CH3:11])[cH:5][c:6]([Cl:9])[cH:7][cH:8]1.[K+:21].[K+:22].[O-:23][C:24]([O-:25])=[O:26].[O:27]1[CH2:28][CH2:29][O:30][CH2:31][CH2:32]1.[c:12]1([B:18]([OH:19])[OH:20])[cH:13][cH:14][cH:15][cH:16][cH:17]1.[cH:33]1[cH:34][cH:35][c:36]([P:37]([Pd:38]([P:39]([c:40]2[cH:41][cH:42][cH:43][cH:44][cH:45]2)([c:46]2[cH:47][cH:48][cH:49][cH:50][cH:51]2)[c:52]2[cH:53][cH:54][cH:55][cH:56][cH:57]2)([P:58]([c:59]2[cH:60][cH:61][cH:62][cH:63][cH:64]2)([c:65]2[cH:66][cH:67][cH:68][cH:69][cH:70]2)[c:71]2[cH:72][cH:73][cH:74][cH:75][cH:76]2)[P:77]([c:78]2[cH:79][cH:80][cH:81][cH:82][cH:83]2)([c:84]2[cH:85][cH:86][cH:87][cH:88][cH:89]2)[c:90]2[cH:91][cH:92][cH:93][cH:94][cH:95]2)([c:96]2[cH:97][cH:98][cH:99][cH:100][cH:101]2)[c:102]2[cH:103][cH:104][cH:105][cH:106][cH:107]2)[cH:108][cH:109]1>>[CH2:2]([c:3]1[c:4]([O:10][CH3:11])[cH:5][c:6]([Cl:9])[cH:7][cH:8]1)[c:12]1[cH:13][cH:14][cH:15][cH:16][cH:17]1