HRID56670

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID46738934

(5-Chloro-2-cyanophenyl)boronic acid

C7H5BClNO2

HCID117622558

未命名化合物

PRODUCTS

生成物

结构：CCOC(=O)C(Cc1ccccc1)n1ccc(-c2cc(Cl)ccc2C#N)cc1=O

HCID117622559

未命名化合物

AUXILIARIES

试剂、催化剂与溶剂

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

催化剂HCID178418397

未命名化合物

PROCEDURE

实验过程

572 mg (1.6 mmol) of ethyl 2-(4-bromo-2-oxopyridin-1(2H)-yl)-3-phenylpropanoate (racemate) and 330 mg (1.8 mmol) of 5-chloro-2-cyanophenylboronic acid in the presence of tetrakis(triphenylphosphine)palladium(0) were reacted according to General Method 2A. Yield: 300 mg (purity 94%, 43% of theory)

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-32bb918ced914e68973c9a55e8bb7444
来源数据集: uspto-grants-2016_09
DOI: 10.6084/m9.figshare.5104873.v1
专利: US09434690B2
来源说明: uspto-grants-2016_09

反应 SMILES

Br[C:2]1[CH:7]=[CH:6][N:5]([CH:8]([CH2:14][C:15]2[CH:20]=[CH:19][CH:18]=[CH:17][CH:16]=2)[C:9]([O:11][CH2:12][CH3:13])=[O:10])[C:4](=[O:21])[CH:3]=1.[Cl:22][C:23]1[CH:24]=[CH:25][C:26]([C:32]#[N:33])=[C:27](B(O)O)[CH:28]=1>C1C=CC([P]([Pd]([P](C2C=CC=CC=2)(C2C=CC=CC=2)C2C=CC=CC=2)([P](C2C=CC=CC=2)(C2C=CC=CC=2)C2C=CC=CC=2)[P](C2C=CC=CC=2)(C2C=CC=CC=2)C2C=CC=CC=2)(C2C=CC=CC=2)C2C=CC=CC=2)=CC=1>[Cl:22][C:23]1[CH:28]=[CH:27][C:26]([C:32]#[N:33])=[C:25]([C:2]2[CH:7]=[CH:6][N:5]([CH:8]([CH2:14][C:15]3[CH:20]=[CH:19][CH:18]=[CH:17][CH:16]=3)[C:9]([O:11][CH2:12][CH3:13])=[O:10])[C:4](=[O:21])[CH:3]=2)[CH:24]=1