HRID307741

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID702

Ethanol

C2H6O

HCID923

Sodium ion

Na+

2 次

HCID8071

未命名化合物

HCID19660

Carbonate

CO3-2

HCID68471

Benzene, 2-bromo-1,3-dimethyl-

C8H9Br

HCID2734367

5-Formyl-2-methoxyphenylboronic acid

C8H9BO4

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

HCID57787305

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-573cf420d6f04fafa393e6fe662e8361
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][c:2]1[c:3]([CH3:9])[cH:4][cH:5][cH:6][c:7]1[CH3:8].[CH2:109]([CH2:110][O:111][CH3:112])[O:113][CH3:114].[CH3:29][CH2:30][OH:31].[CH:10](=[O:11])[c:12]1[cH:13][cH:14][c:15]([O:21][CH3:22])[c:16]([B:18]([OH:19])[OH:20])[cH:17]1.[Na+:23].[Na+:24].[O-:25][C:26](=[O:27])[O-:28].[cH:32]1[cH:33][cH:34][c:35]([P:36]([Pd:37]([P:38]([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)[c:51]2[cH:52][cH:53][cH:54][cH:55][cH:56]2)([P:57]([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)[c:70]2[cH:71][cH:72][cH:73][cH:74][cH:75]2)[P:76]([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)[c:101]2[cH:102][cH:103][cH:104][cH:105][cH:106]2)[cH:107][cH:108]1>>[c:2]1(-[c:16]2[c:15]([O:21][CH3:22])[cH:14][cH:13][c:12]([CH:10]=[O:11])[cH:17]2)[c:3]([CH3:9])[cH:4][cH:5][cH:6][c:7]1[CH3:8]