HRID810532

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID702

Ethanol

C2H6O

HCID923

Sodium ion

Na+

2 次

HCID962

Water

H2O

HCID1140

Toluene

C7H8

HCID19660

Carbonate

CO3-2

HCID285645

4-Fluorophenylboronic acid

C6H6BFO2

结构：COC(=O)c1c(OS(=O)(=O)C(F)(F)F)c2cc(Cl)ccc2c(=O)n1Cc1ccccc1

HCID86599557

未命名化合物

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

结构：COC(=O)c1c(-c2ccc(F)cc2)c2cc(Cl)ccc2c(=O)n1Cc1ccccc1

HCID69156801

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-1b22be24d9774db898a4a39bb3b8efe7
来源数据集: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Test data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[CH3:132][CH2:133][OH:134].[CH3:1][O:2][C:3](=[O:4])[c:5]1[n:6]([CH2:25][c:26]2[cH:27][cH:28][cH:29][cH:30][cH:31]2)[c:7](=[O:24])[c:8]2[cH:9][cH:10][c:11]([Cl:23])[cH:12][c:13]2[c:14]1[O:15][S:16]([C:17]([F:18])([F:19])[F:20])(=[O:21])=[O:22].[CH3:48][c:49]1[cH:50][cH:51][cH:52][cH:53][cH:54]1.[Na+:32].[Na+:33].[O-:34][C:35](=[O:36])[O-:37].[OH2:135].[OH:38][B:39]([OH:40])[c:41]1[cH:42][cH:43][c:44]([F:45])[cH:46][cH:47]1.[cH:55]1[cH:56][cH:57][c:58]([P:59]([Pd:60]([P:61]([c:62]2[cH:63][cH:64][cH:65][cH:66][cH:67]2)([c:68]2[cH:69][cH:70][cH:71][cH:72][cH:73]2)[c:74]2[cH:75][cH:76][cH:77][cH:78][cH:79]2)([P:80]([c:81]2[cH:82][cH:83][cH:84][cH:85][cH:86]2)([c:87]2[cH:88][cH:89][cH:90][cH:91][cH:92]2)[c:93]2[cH:94][cH:95][cH:96][cH:97][cH:98]2)[P:99]([c:100]2[cH:101][cH:102][cH:103][cH:104][cH:105]2)([c:106]2[cH:107][cH:108][cH:109][cH:110][cH:111]2)[c:112]2[cH:113][cH:114][cH:115][cH:116][cH:117]2)([c:118]2[cH:119][cH:120][cH:121][cH:122][cH:123]2)[c:124]2[cH:125][cH:126][cH:127][cH:128][cH:129]2)[cH:130][cH:131]1>>[CH3:1][O:2][C:3](=[O:4])[c:5]1[n:6]([CH2:25][c:26]2[cH:27][cH:28][cH:29][cH:30][cH:31]2)[c:7](=[O:24])[c:8]2[cH:9][cH:10][c:11]([Cl:23])[cH:12][c:13]2[c:14]1-[c:41]1[cH:42][cH:43][c:44]([F:45])[cH:46][cH:47]1