HRID831633

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID175

Acetate

C2H3O2-

2 次

HCID923

Sodium ion

Na+

HCID962

Water

H2O

HCID1140

Toluene

C7H8

HCID53167

1-Methylpiperazine

C5H12N2

HCID83681

Tris(1,1-dimethylethyl)phosphine

C12H27P

HCID105144

Palladium(2+)

Pd+2

HCID4574913

未命名化合物

HCID136005882

未命名化合物

PRODUCTS

产物

HCID136005783

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-7afe71f5b34740cd91fb42e3b885e6a4
来源数据集: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Test data from https://doi.org/10.1039/C8SC04228D

反应SMILES

[Br:27][c:28]1[cH:29][c:30]([O:51][CH3:52])[c:31](-[c:34]2[nH:35][c:36](=[O:50])[c:37]3[c:38]([n:39]2)[c:40]([CH3:49])[n:41][n:42]3[CH:43]2[CH2:44][CH2:45][CH2:46][CH2:47][CH2:48]2)[cH:32][cH:33]1.[C:14]([P:15]([C:16]([CH3:17])([CH3:18])[CH3:19])[C:20]([CH3:21])([CH3:22])[CH3:23])([CH3:24])([CH3:25])[CH3:26].[CH3:1][N:2]1[CH2:3][CH2:4][NH:5][CH2:6][CH2:7]1.[CH3:63][c:64]1[cH:65][cH:66][cH:67][cH:68][cH:69]1.[CH3:8][C:9]([CH3:10])([O-:11])[CH3:12].[Na+:13].[O-:55][C:56]([CH3:57])=[O:58].[O-:59][C:60]([CH3:61])=[O:62].[OH2:53].[Pd+2:54]>>[CH3:1][N:2]1[CH2:3][CH2:4][N:5]([c:28]2[cH:29][c:30]([O:51][CH3:52])[c:31](-[c:34]3[nH:35][c:36](=[O:50])[c:37]4[c:38]([n:39]3)[c:40]([CH3:49])[n:41][n:42]4[CH:43]3[CH2:44][CH2:45][CH2:46][CH2:47][CH2:48]3)[cH:32][cH:33]2)[CH2:6][CH2:7]1