HRID1215938

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

2 次

HCID962

Water

H2O

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID19660

Carbonate

CO3-2

HCID66827

Boronic acid, phenyl-

C6H7BO2

HCID11424498

Methyl 4-bromo-1-methyl-1H-pyrrole-2-carboxylate

C7H8BrNO2

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

HCID66967497

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-f63f8c8a1b954bf0996c1ba5e618fe32
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应 SMILES

[C:21](=[O:22])([O-:23])[O-:24].[CH3:1][O:2][C:3](=[O:4])[c:5]1[n:6]([CH3:11])[cH:7][c:8]([Br:10])[cH:9]1.[Na+:25].[Na+:26].[O:27]=[CH:28][N:29]([CH3:30])[CH3:31].[OH2:32].[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>>[CH3:1][O:2][C:3](=[O:4])[c:5]1[n:6]([CH3:11])[cH:7][c:8](-[c:12]2[cH:13][cH:14][cH:15][cH:16][cH:17]2)[cH:9]1