HRID2125198

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

2 次

HCID923

Sodium ion

Na+

2 次

HCID8028

Tetrahydrofuran

C4H8O

HCID8857

Ethyl acetate

C4H8O2

HCID19660

Carbonate

CO3-2

2 次

HCID14026183

1-Bromo-4-(2-methoxyethoxy)benzene

C9H11BrO2

HCID24208789

5-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrrolo[2,3-b]pyridine

C13H17BN2O2

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

HCID58087134

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-4b28f9d7082b4a458839d7be04eb3cec
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (4/10)

反应 SMILES

[Br:19][c:20]1[cH:21][cH:22][c:23]([O:26][CH2:27][CH2:28][O:29][CH3:30])[cH:24][cH:25]1.[C:31](=[O:32])([O-:33])[O-:34].[CH3:1][C:2]1([CH3:3])[C:4]([CH3:5])([CH3:6])[O:7][B:8]([c:9]2[cH:10][c:11]3[c:12]([n:13][cH:14]2)[nH:15][cH:16][cH:17]3)[O:18]1.[CH3:42][CH2:43][O:44][C:45](=[O:46])[CH3:47].[K+:35].[K+:36].[Na+:48].[Na+:49].[O-:50][C:51](=[O:52])[O-:53].[O:37]1[CH2:38][CH2:39][CH2:40][CH2:41]1.[cH:54]1[cH:55][cH:56][c:57]([P:58]([Pd:59]([P:60]([c:61]2[cH:62][cH:63][cH:64][cH:65][cH:66]2)([c:67]2[cH:68][cH:69][cH:70][cH:71][cH:72]2)[c:73]2[cH:74][cH:75][cH:76][cH:77][cH:78]2)([P:79]([c:80]2[cH:81][cH:82][cH:83][cH:84][cH:85]2)([c:86]2[cH:87][cH:88][cH:89][cH:90][cH:91]2)[c:92]2[cH:93][cH:94][cH:95][cH:96][cH:97]2)[P:98]([c:99]2[cH:100][cH:101][cH:102][cH:103][cH:104]2)([c:105]2[cH:106][cH:107][cH:108][cH:109][cH:110]2)[c:111]2[cH:112][cH:113][cH:114][cH:115][cH:116]2)([c:117]2[cH:118][cH:119][cH:120][cH:121][cH:122]2)[c:123]2[cH:124][cH:125][cH:126][cH:127][cH:128]2)[cH:129][cH:130]1>>[c:9]1(-[c:20]2[cH:21][cH:22][c:23]([O:26][CH2:27][CH2:28][O:29][CH3:30])[cH:24][cH:25]2)[cH:10][c:11]2[c:12]([n:13][cH:14]1)[nH:15][cH:16][cH:17]2