HRID147604

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

HCID1140

Toluene

C7H8

HCID6920

Ethanone, 1-(2-thienyl)-

C6H6OS

HCID7961

Bromobenzene

C6H5Br

HCID8857

Ethyl acetate

C4H8O2

结构：c1ccc(P(c2ccccc2)c2ccc3ccccc3c2-c2c(P(c3ccccc3)c3ccccc3)ccc3ccccc23)cc1

HCID634876

2,2'-Bis(diphenylphosphino)-1,1'-binaphthyl

C44H32P2

HCID3280088

未命名化合物

PRODUCTS

生成物

HCID687090

2-phenyl-1-(thiophen-2-yl)ethanone

C12H10OS

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-18369ade136b466e8e9cc6c44b9c8d7f
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][cH:4][cH:5][cH:6][cH:7]1.[CH3:16][Si:17]([N-:18][Si:19]([CH3:20])([CH3:21])[CH3:22])([CH3:23])[CH3:24].[CH3:72][c:73]1[cH:74][cH:75][cH:76][cH:77][cH:78]1.[CH3:79][CH2:80][O:81][C:82](=[O:83])[CH3:84].[K+:25].[c:26]1([P:27]([c:28]2[cH:29][cH:30][cH:31][cH:32][cH:33]2)[c:34]2[cH:35][cH:36][c:37]3[c:38]([cH:39][cH:40][cH:41][cH:42]3)[c:43]2-[c:44]2[c:45]3[c:46]([cH:47][cH:48][cH:49][cH:50]3)[cH:51][cH:52][c:53]2[P:54]([c:55]2[cH:56][cH:57][cH:58][cH:59][cH:60]2)[c:61]2[cH:62][cH:63][cH:64][cH:65][cH:66]2)[cH:67][cH:68][cH:69][cH:70][cH:71]1.[s:8]1[c:9]([C:13]([CH3:14])=[O:15])[cH:10][cH:11][cH:12]1>>[c:2]1([CH2:14][C:13]([c:9]2[s:8][cH:12][cH:11][cH:10]2)=[O:15])[cH:3][cH:4][cH:5][cH:6][cH:7]1