HRID2147349

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID175

Acetate

C2H3O2-

2 次

HCID923

Sodium ion

Na+

HCID1140

Toluene

C7H8

HCID8857

Ethyl acetate

C4H8O2

HCID12162

Benzonitrile, 4-bromo-

C7H4BrN

HCID105144

Palladium(2+)

Pd+2

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

HCID634876

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

C44H32P2

HCID4574913

未命名化合物

HCID11481328

4-(TERT-BUTYLDIMETHYLSILYLOXY)PIPERIDINE

C11H25NOSi

PRODUCTS

生成物

结构：CC(C)(C)[Si](C)(C)OC1CCN(c2ccc(C#N)cc2)CC1

HCID69480528

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-60efa6691faa4d0ea90d796a33831980
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (4/10)

反应 SMILES

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