HRID813519

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID175

Acetate

C2H3O2-

2 次

HCID702

Ethanol

C2H6O

HCID923

Sodium ion

Na+

2 次

HCID962

Water

H2O

HCID8028

Tetrahydrofuran

C4H8O

HCID19660

Carbonate

CO3-2

HCID105144

Palladium(2+)

Pd+2

HCID642851

Diethyl(3-pyridyl)borane

C9H14BN

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

HCID2734217

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

C26H36NP

HCID21269135

Ethyl 5-chloro-2-methylbenzoate

C10H11ClO2

PRODUCTS

生成物

HCID18448504

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-8c596f8e02334c92be20fe02056f7140
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

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