HRID1204596

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID3283

Diethyl Ether

C4H10O

HCID8028

Tetrahydrofuran

C4H8O

HCID9025

1,3-Dimethoxybenzene

C8H10O2

HCID19660

Carbonate

CO3-2

HCID23938

Palladium

2 次

HCID61668

Boronic acid

H3BO2

HCID95417

1,5-Diphenyl-1,4-pentadien-3-one

C17H14O

3 次

HCID104967

Cesium(1+)

Cs+

2 次

HCID22452154

2-(Benzyloxy)-4-chlorobenzoic acid

C14H11ClO3

PRODUCTS

生成物

结构：COc1cccc(OC)c1-c1ccc(C(=O)O)c(OCc2ccccc2)c1

HCID22452146

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-4a3d265ce57a497bbca8efcb3510b396
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应 SMILES

[BH:19]([OH:20])[OH:21].[C:32](=[O:33])([O-:34])[O-:35].[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[c:10]([C:11](=[O:12])[OH:13])[cH:14][cH:15][c:16]([Cl:18])[cH:17]1.[CH2:38]1[O:39][CH2:40][CH2:41][CH2:42]1.[CH3:22][O:23][c:24]1[cH:25][c:26]([O:30][CH3:31])[cH:27][cH:28][cH:29]1.[CH3:43][CH2:44][O:45][CH2:46][CH3:47].[Cs+:36].[Cs+:37].[O:51]=[C:52]([CH:53]=[CH:54][c:55]1[cH:56][cH:57][cH:58][cH:59][cH:60]1)[CH:61]=[CH:62][c:63]1[cH:64][cH:65][cH:66][cH:67][cH:68]1.[O:69]=[C:70]([CH:71]=[CH:72][c:73]1[cH:74][cH:75][cH:76][cH:77][cH:78]1)[CH:79]=[CH:80][c:81]1[cH:82][cH:83][cH:84][cH:85][cH:86]1.[O:87]=[C:88]([CH:89]=[CH:90][c:91]1[cH:92][cH:93][cH:94][cH:95][cH:96]1)[CH:97]=[CH:98][c:99]1[cH:100][cH:101][cH:102][cH:103][cH:104]1.[OH2:48].[Pd:49].[Pd:50]>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[c:10]([C:11](=[O:12])[OH:13])[cH:14][cH:15][c:16](-[c:25]2[c:24]([O:23][CH3:22])[cH:29][cH:28][cH:27][c:26]2[O:30][CH3:31])[cH:17]1