HRID173191

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID175

Acetate

C2H3O2-

2 次

HCID923

Sodium ion

Na+

HCID961

Hydroxide

HO-

HCID962

Water

H2O

HCID7501

Styrene

C8H8

HCID8857

Ethyl acetate

C4H8O2

HCID28179

Fluoride

F-

HCID31275

1,4-Dioxane

C4H8O2

HCID78966

9-Borabicyclo[3.3.1]nonane

C8H15B

HCID104967

Cesium(1+)

Cs+

HCID105144

Palladium(2+)

Pd+2

结构：CN(C)c1ccccc1-c1ccccc1P(C1CCCCC1)C1CCCCC1

HCID2734217

2-Dicyclohexylphosphino-2'-(N,N-dimethylamino)biphenyl

C26H36NP

结构：CCCC(=O)Nc1nn(COCC[Si](C)(C)C)c2cc(Cl)ccc12

HCID10406687

N-[6-chloro-1-[[2-(trimethylsilyl)ethoxy)methyl]-1H-indazol-3-yl)butanamide

C17H26ClN3O2Si

PRODUCTS

生成物

结构：CCCC(=O)Nc1nn(COCC[Si](C)(C)C)c2cc(CCc3ccccc3)ccc12

HCID22319517

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-2c2a87ab47554bcfbced85e81f62ab6a
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

[C:80]([O-:81])(=[O:82])[CH3:83].[C:85]([O-:86])(=[O:87])[CH3:88].[CH2:10]=[CH:11][c:12]1[cH:13][cH:14][cH:15][cH:16][cH:17]1.[CH3:89][CH2:90][O:91][C:92](=[O:93])[CH3:94].[CH:1]12[CH2:2][CH2:3][CH2:4][CH:5]([BH:6]1)[CH2:7][CH2:8][CH2:9]2.[CH:46]1([P:47]([CH:48]2[CH2:49][CH2:50][CH2:51][CH2:52][CH2:53]2)[c:54]2[cH:55][cH:56][cH:57][cH:58][c:59]2-[c:60]2[cH:61][cH:62][cH:63][cH:64][c:65]2[N:66]([CH3:67])[CH3:68])[CH2:69][CH2:70][CH2:71][CH2:72][CH2:73]1.[Cl:20][c:21]1[cH:22][cH:23][c:24]2[c:25]([NH:38][C:39]([CH2:40][CH2:41][CH3:42])=[O:43])[n:26][n:27]([CH2:30][O:31][CH2:32][CH2:33][Si:34]([CH3:35])([CH3:36])[CH3:37])[c:28]2[cH:29]1.[Cs+:45].[F-:44].[Na+:19].[O:74]1[CH2:75][CH2:76][O:77][CH2:78][CH2:79]1.[OH-:18].[OH2:95].[Pd+2:84]>>[CH2:10]([CH2:11][c:12]1[cH:13][cH:14][cH:15][cH:16][cH:17]1)[c:21]1[cH:22][cH:23][c:24]2[c:25]([NH:38][C:39]([CH2:40][CH2:41][CH3:42])=[O:43])[n:26][n:27]([CH2:30][O:31][CH2:32][CH2:33][Si:34]([CH3:35])([CH3:36])[CH3:37])[c:28]2[cH:29]1