HRID940910

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID702

Ethanol

C2H6O

HCID813

Potassium cation

K+

2 次

HCID962

Water

H2O

HCID1140

Toluene

C7H8

HCID3283

Diethyl Ether

C4H10O

HCID19660

Carbonate

CO3-2

HCID61668

Boronic acid

H3BO2

HCID21112957

未命名化合物

HCID58731002

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)c1cc(NC(C)=O)ccc1-c1ccccc1-c1cc(C(F)(F)F)ccc1OCc1ccc(F)cc1F

HCID58731000

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-f093df7f93454d85adb91f08b43ca49e
来源数据集: Validation data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Validation data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[BH:1]([OH:2])[OH:3].[C:24]([CH3:25])(=[O:26])[NH:27][c:28]1[cH:29][c:30]([C:41](=[O:42])[O:43][CH3:44])[c:31](-[c:34]2[c:35]([Br:40])[cH:36][cH:37][cH:38][cH:39]2)[cH:32][cH:33]1.[C:45](=[O:46])([O-:47])[O-:48].[CH2:51]([OH:52])[CH3:53].[CH3:61][CH2:62][O:63][CH2:64][CH3:65].[F:4][c:5]1[c:6]([CH2:7][O:8][c:9]2[cH:10][cH:11][c:12]([C:15]([F:16])([F:17])[F:18])[cH:13][cH:14]2)[cH:19][cH:20][c:21]([F:23])[cH:22]1.[K+:49].[K+:50].[OH2:66].[c:54]1([CH3:55])[cH:56][cH:57][cH:58][cH:59][cH:60]1.[cH:67]1[cH:68][cH:69][c:70]([P:71]([Pd:72]([P:73]([c:74]2[cH:75][cH:76][cH:77][cH:78][cH:79]2)([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)([P:92]([c:93]2[cH:94][cH:95][cH:96][cH:97][cH:98]2)([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)[P:111]([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)([c:130]2[cH:131][cH:132][cH:133][cH:134][cH:135]2)[c:136]2[cH:137][cH:138][cH:139][cH:140][cH:141]2)[cH:142][cH:143]1>>[F:4][c:5]1[c:6]([CH2:7][O:8][c:9]2[c:10](-[c:35]3[c:34](-[c:31]4[c:30]([C:41](=[O:42])[O:43][CH3:44])[cH:29][c:28]([NH:27][C:24]([CH3:25])=[O:26])[cH:33][cH:32]4)[cH:39][cH:38][cH:37][cH:36]3)[cH:11][c:12]([C:15]([F:16])([F:17])[F:18])[cH:13][cH:14]2)[cH:19][cH:20][c:21]([F:23])[cH:22]1