HRID157233

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8071

未命名化合物

HCID11456

m-Bromobenzoic acid

C7H5BrO2

HCID11776

Triphenylphosphine

C18H15P

4 次

HCID19660

Carbonate

CO3-2

HCID23938

Palladium

HCID104967

Cesium(1+)

Cs+

2 次

HCID2734350

4-Ethoxycarbonylphenylboronic acid

C9H11BO4

PRODUCTS

生成物

HCID53218412

4'-(Ethoxycarbonyl)[1,1'-biphenyl]-3-carboxylic acid

C16H14O4

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-5d127c2a04354b82a0c62b107c60ed4a
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

[Br:1][c:2]1[cH:3][c:4]([C:5](=[O:6])[OH:7])[cH:8][cH:9][cH:10]1.[C:25](=[O:26])([O-:27])[O-:28].[CH2:11]([CH3:12])[O:13][C:14](=[O:15])[c:16]1[cH:17][cH:18][c:19]([B:22]([OH:23])[OH:24])[cH:20][cH:21]1.[CH3:31][O:32][CH2:33][CH2:34][O:35][CH3:36].[Cs+:29].[Cs+:30].[Pd:37].[c:38]1([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)[cH:52][cH:53][cH:54][cH:55][cH:56]1.[c:57]1([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)[cH:71][cH:72][cH:73][cH:74][cH:75]1.[c:76]1([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)[cH:90][cH:91][cH:92][cH:93][cH:94]1.[c:95]1([P:96]([c:97]2[cH:98][cH:99][cH:100][cH:101][cH:102]2)[c:103]2[cH:104][cH:105][cH:106][cH:107][cH:108]2)[cH:109][cH:110][cH:111][cH:112][cH:113]1>>[c:2]1(-[c:19]2[cH:18][cH:17][c:16]([C:14]([O:13][CH2:11][CH3:12])=[O:15])[cH:21][cH:20]2)[cH:3][c:4]([C:5](=[O:6])[OH:7])[cH:8][cH:9][cH:10]1