HRID209490

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

2 次

HCID8028

Tetrahydrofuran

C4H8O

HCID11202

1-Propene, 2-bromo-

C3H5Br

HCID19660

Carbonate

CO3-2

HCID2734689

3,5-Dibromophenylboronic acid

C6H5BBr2O2

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

HCID21468195

1,3-Dibromo-5-(1-methylethenyl)benzene

C9H8Br2

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-b1055da4b9df4ae0bf9b370ac5bd95b5
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:12][C:13](=[CH2:14])[CH3:15].[Br:1][c:2]1[cH:3][c:4]([B:9]([OH:10])[OH:11])[cH:5][c:6]([Br:8])[cH:7]1.[C:21](=[O:22])([O-:23])[O-:24].[CH2:16]1[O:17][CH2:18][CH2:19][CH2:20]1.[Na+:25].[Na+:26].[cH:27]1[cH:28][cH:29][c:30]([P:31]([Pd:32]([P:33]([c:34]2[cH:35][cH:36][cH:37][cH:38][cH:39]2)([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)([P:52]([c:53]2[cH:54][cH:55][cH:56][cH:57][cH:58]2)([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)[P:71]([c:72]2[cH:73][cH:74][cH:75][cH:76][cH:77]2)([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)[cH:102][cH:103]1>>[Br:1][c:2]1[cH:3][c:4]([C:13](=[CH2:14])[CH3:15])[cH:5][c:6]([Br:8])[cH:7]1