HRID942706

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID175

Acetate

C2H3O2-

2 次

HCID313

Hydrochloric Acid

ClH

HCID962

Water

H2O

HCID1140

Toluene

C7H8

HCID8028

Tetrahydrofuran

C4H8O

HCID19660

Carbonate

CO3-2

HCID33721

4-Piperidone

C5H9NO

HCID104967

Cesium(1+)

Cs+

2 次

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

HCID12508378

2-Chloro-4,6-dimethylpyridine

C7H8ClN

PRODUCTS

生成物

HCID66851340

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-049d91d64c9942afa84fb5922c87e0bf
来源数据集: Validation data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Validation data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[C:1](=[O:2])([O-:3])[O-:4].[C:83]([O-:84])(=[O:85])[CH3:86].[C:88]([O-:89])(=[O:90])[CH3:91].[CH3:70][c:71]1[cH:72][cH:73][cH:74][cH:75][cH:76]1.[Cl:15][c:16]1[n:17][c:18]([CH3:23])[cH:19][c:20]([CH3:22])[cH:21]1.[ClH:7].[Cs+:5].[Cs+:6].[NH:8]1[CH2:9][CH2:10][C:11](=[O:14])[CH2:12][CH2:13]1.[O:77]1[CH2:78][CH2:79][CH2:80][CH2:81]1.[OH2:82].[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>>[N:8]1([c:16]2[n:17][c:18]([CH3:23])[cH:19][c:20]([CH3:22])[cH:21]2)[CH2:9][CH2:10][C:11](=[O:14])[CH2:12][CH2:13]1