HRID305345

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID259

Bromide

Br-

HCID312

Chloride

Cl-

2 次

HCID8028

Tetrahydrofuran

C4H8O

HCID11522

Benzene, 1-bromo-4-iodo-

C6H4BrI

HCID32051

Zinc (II) cation

Zn+2

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

HCID178424302

未命名化合物

PRODUCTS

生成物

HCID15205876

4'-Bromo-2-methyl-1,1'-biphenyl

C13H11Br

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-8b988a97a0fb4869b4fea7911e540f30
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

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