HRID97359

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID241

Benzene

C6H6

HCID702

Ethanol

C2H6O

HCID923

Sodium ion

Na+

2 次

HCID962

Water

H2O

HCID11776

Triphenylphosphine

C18H15P

4 次

HCID19660

Carbonate

CO3-2

HCID23938

Palladium

HCID2734354

(2-Fluorophenyl)boronato(2-)

C6H6BFO2

HCID21986094

未命名化合物

PRODUCTS

生成物

HCID21986107

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-e22d9bb3b544449fb89096824f1efdaa
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

[Br:1][C:2]1=[CH:6][CH2:5][CH2:4][CH:3]1[CH2:7][CH2:8][OH:9].[C:10](=[O:11])([O-:12])[O-:13].[CH3:32][CH2:33][OH:34].[F:16][c:17]1[c:18]([B:23]([OH:24])[OH:25])[cH:19][cH:20][cH:21][cH:22]1.[Na+:14].[Na+:15].[OH2:35].[Pd:36].[c:37]1([P:38]([c:39]2[cH:40][cH:41][cH:42][cH:43][cH:44]2)[c:45]2[cH:46][cH:47][cH:48][cH:49][cH:50]2)[cH:51][cH:52][cH:53][cH:54][cH:55]1.[c:56]1([P:57]([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)[cH:70][cH:71][cH:72][cH:73][cH:74]1.[c:75]1([P:76]([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)[cH:89][cH:90][cH:91][cH:92][cH:93]1.[c:94]1([P:95]([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)[cH:108][cH:109][cH:110][cH:111][cH:112]1.[cH:26]1[cH:27][cH:28][cH:29][cH:30][cH:31]1>>[C:2]1([c:18]2[c:17]([F:16])[cH:22][cH:21][cH:20][cH:19]2)=[CH:6][CH2:5][CH2:4][CH:3]1[CH2:7][CH2:8][OH:9]