HRID1547695

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

2 次

HCID962

Water

H2O

HCID8071

未命名化合物

HCID11776

Triphenylphosphine

C18H15P

4 次

HCID13851

Thiophene, 2-bromo-

C4H3BrS

HCID19660

Carbonate

CO3-2

HCID23938

Palladium

HCID285645

4-Fluorophenylboronic acid

C6H6BFO2

PRODUCTS

生成物

HCID21894783

2-(4-Fluorophenyl)thiophene

C10H7FS

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-6c714e98c7ea418c8a74dd3dc3d13f42
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (1/10)

反应 SMILES

[Br:17][c:18]1[s:19][cH:20][cH:21][cH:22]1.[CH2:24]([CH2:25][O:26][CH3:27])[O:28][CH3:29].[F:7][c:8]1[cH:9][cH:10][c:11]([B:14]([OH:15])[OH:16])[cH:12][cH:13]1.[Na+:1].[Na+:2].[O-:3][C:4](=[O:5])[O-:6].[OH2:23].[Pd:30].[c:31]1([P:32]([c:33]2[cH:34][cH:35][cH:36][cH:37][cH:38]2)[c:39]2[cH:40][cH:41][cH:42][cH:43][cH:44]2)[cH:45][cH:46][cH:47][cH:48][cH:49]1.[c:50]1([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)[cH:64][cH:65][cH:66][cH:67][cH:68]1.[c:69]1([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)[cH:83][cH:84][cH:85][cH:86][cH:87]1.[c:88]1([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)[cH:102][cH:103][cH:104][cH:105][cH:106]1>>[F:7][c:8]1[cH:9][cH:10][c:11](-[c:18]2[s:19][cH:20][cH:21][cH:22]2)[cH:12][cH:13]1