HRID193517

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

2 次

HCID962

Water

H2O

HCID1140

Toluene

C7H8

HCID6342

Acetonitrile

C2H3N

HCID7914

Isopropyl ether

C6H14O

HCID8028

Tetrahydrofuran

C4H8O

HCID19660

Carbonate

CO3-2

HCID151253

1,1'-Biphenyl-4-yl-boronic acid

C12H11BO2

HCID817700

2-Amino-3-bromopyridine

C5H5BrN2

结构：c1ccc([PH](c2ccccc2)(c2ccccc2)[Pd]([PH](c2ccccc2)(c2ccccc2)c2ccccc2)([PH](c2ccccc2)(c2ccccc2)c2ccccc2)[PH](c2ccccc2)(c2ccccc2)c2ccccc2)cc1

HCID178420554

未命名化合物

PRODUCTS

生成物

HCID65454950

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-fdfcc10e516c42bda0abf444ba7210aa
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

[Br:22][c:23]1[c:24]([NH2:29])[n:25][cH:26][cH:27][cH:28]1.[CH2:37]1[O:38][CH2:39][CH2:40][CH2:41]1.[CH3:119][C:120]#[N:121].[CH3:122][c:123]1[cH:124][cH:125][cH:126][cH:127][cH:128]1.[CH:30]([O:31][CH:32]([CH3:33])[CH3:34])([CH3:35])[CH3:36].[Na+:1].[Na+:2].[O-:3][C:4](=[O:5])[O-:6].[OH2:129].[c:7]1(-[c:16]2[cH:17][cH:18][cH:19][cH:20][cH:21]2)[cH:8][cH:9][c:10]([B:13]([OH:14])[OH:15])[cH:11][cH:12]1.[cH:42]1[cH:43][cH:44][c:45]([P:46]([Pd:47]([P:48]([c:49]2[cH:50][cH:51][cH:52][cH:53][cH:54]2)([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)([P:67]([c:68]2[cH:69][cH:70][cH:71][cH:72][cH:73]2)([c:74]2[cH:75][cH:76][cH:77][cH:78][cH:79]2)[c:80]2[cH:81][cH:82][cH:83][cH:84][cH:85]2)[P:86]([c:87]2[cH:88][cH:89][cH:90][cH:91][cH:92]2)([c:93]2[cH:94][cH:95][cH:96][cH:97][cH:98]2)[c:99]2[cH:100][cH:101][cH:102][cH:103][cH:104]2)([c:105]2[cH:106][cH:107][cH:108][cH:109][cH:110]2)[c:111]2[cH:112][cH:113][cH:114][cH:115][cH:116]2)[cH:117][cH:118]1>>[c:7]1(-[c:16]2[cH:17][cH:18][cH:19][cH:20][cH:21]2)[cH:8][cH:9][c:10](-[c:23]2[c:24]([NH2:29])[n:25][cH:26][cH:27][cH:28]2)[cH:11][cH:12]1