HRID821889

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

2 次

HCID947

Nitrogen

HCID962

Water

H2O

HCID19660

Carbonate

CO3-2

HCID7018047

2-Bromo-5-(trifluoromethyl)benzaldehyde

C8H4BrF3O

结构：CCOC(=O)Cc1ccc(OC)c(B2OC(C)(C)C(C)(C)O2)c1

HCID58120060

[4-Methoxy-3-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)phenyl]acetic acid ethyl ester

C17H25BO5

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：CCOC(=O)Cc1ccc(OC)c(-c2ccc(C(F)(F)F)cc2C=O)c1

HCID86633171

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-c5e4c3e1e9ec40b28da605c5c6c660fb
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

[Br:24][c:25]1[c:26]([CH:27]=[O:28])[cH:29][c:30]([C:33]([F:34])([F:35])[F:36])[cH:31][cH:32]1.[C:37](=[O:38])([O-:39])[O-:40].[CH2:1]([CH3:2])[O:3][C:4]([CH2:5][c:6]1[cH:7][c:8]([B:14]2[O:15][C:16]([CH3:17])([CH3:18])[C:19]([CH3:20])([CH3:21])[O:22]2)[c:9]([O:12][CH3:13])[cH:10][cH:11]1)=[O:23].[K+:41].[K+:42].[N:43]#[N:44].[OH2:122].[cH:45]1[cH:46][cH:47][c:48]([P:49]([Pd:50]([P:51]([c:52]2[cH:53][cH:54][cH:55][cH:56][cH:57]2)([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)([P:70]([c:71]2[cH:72][cH:73][cH:74][cH:75][cH:76]2)([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)[P:89]([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)([c:108]2[cH:109][cH:110][cH:111][cH:112][cH:113]2)[c:114]2[cH:115][cH:116][cH:117][cH:118][cH:119]2)[cH:120][cH:121]1>>[CH2:1]([CH3:2])[O:3][C:4]([CH2:5][c:6]1[cH:7][c:8](-[c:25]2[c:26]([CH:27]=[O:28])[cH:29][c:30]([C:33]([F:34])([F:35])[F:36])[cH:31][cH:32]2)[c:9]([O:12][CH3:13])[cH:10][cH:11]1)=[O:23]