HRID1220194

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

HCID1140

Toluene

C7H8

HCID8058

n-Hexane

C6H14

HCID13831

Tributylphosphine

C12H27P

HCID23938

Palladium

2 次

HCID28179

Fluoride

F-

2 次

结构：C=[CH][Sn]([CH2]CCC)([CH2]CCC)[CH2]CCC

HCID81998

Ethynyltributylstannane

C14H30Sn

HCID95417

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

C17H14O

3 次

HCID104967

Cesium(1+)

Cs+

HCID22337825

4-Bromo-2-(trifluoromethyl)benzonitrile

C8H3BrF3N

PRODUCTS

生成物

HCID66955245

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-ac36b405c5d240878548891dd94c6d83
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

[Br:1][c:2]1[cH:3][c:4]([C:10]([F:11])([F:12])[F:13])[c:5]([C:6]#[N:7])[cH:8][cH:9]1.[CH2:16]([CH2:17][CH2:27][CH3:28])[P:18]([CH2:19][CH2:20][CH2:21][CH3:22])[CH2:23][CH2:24][CH2:25][CH3:26].[CH2:35]([Sn:36]([CH2:37][CH2:38][CH2:39][CH3:40])([CH2:41][CH2:42][CH2:43][CH3:44])[CH:45]=[CH2:46])[CH2:47][CH2:48][CH3:49].[CH3:29][CH2:30][CH2:31][CH2:32][CH2:33][CH3:34].[CH3:52][c:53]1[cH:54][cH:55][cH:56][cH:57][cH:58]1.[Cs+:15].[F-:14].[F-:50].[K+:51].[O:61]=[C:62]([CH:63]=[CH:64][c:65]1[cH:66][cH:67][cH:68][cH:69][cH:70]1)[CH:71]=[CH:72][c:73]1[cH:74][cH:75][cH:76][cH:77][cH:78]1.[O:79]=[C:80]([CH:81]=[CH:82][c:83]1[cH:84][cH:85][cH:86][cH:87][cH:88]1)[CH:89]=[CH:90][c:91]1[cH:92][cH:93][cH:94][cH:95][cH:96]1.[O:97]=[C:98]([CH:99]=[CH:100][c:101]1[cH:102][cH:103][cH:104][cH:105][cH:106]1)[CH:107]=[CH:108][c:109]1[cH:110][cH:111][cH:112][cH:113][cH:114]1.[Pd:59].[Pd:60]>>[c:2]1([CH:16]=[CH2:17])[cH:3][c:4]([C:10]([F:11])([F:12])[F:13])[c:5]([C:6]#[N:7])[cH:8][cH:9]1