HRID863759

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6410

tert-Butyl hydroperoxide

C4H10O2

2 次

结构：COc1cc(OC)nc(Cc2onc(-c3ccccc3)c2C(=O)N(C)c2ccccc2)n1

HCID19050670

未命名化合物

PRODUCTS

生成物

结构：COc1cc(OC)nc(C(=O)c2onc(-c3ccccc3)c2C(=O)N(C)c2ccccc2)n1

HCID19050660

未命名化合物

AUXILIARIES

试剂、催化剂与溶剂

结构：[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[CH-]=O.[CH-]=O.[Co+2].[Co]

催化剂HCID25049

未命名化合物

溶剂HCID6342

Acetonitrile

C2H3N

PROCEDURE

实验过程

A solution of 100 mg of N-methyl 3-phenyl-5-(4,6-dimethoxy-2-pyrimidinylmethyl)-4-isoxazolecarboxanilide, 20 mg of dicobalt octacarbonyl, and 1 ml of t-butylhydroperoxide, in 60 ml of acetonitrile is refluxed for 48 hours. An additional 1 ml of t-butylhydroperoxide is added after 12 hrs and 24 hrs. Thin layer chromatography after 48 hrs indicates the presence of starting material and the title compound.

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-776e651b363d4802847ce5c4cfead691
来源数据集: uspto-grants-1996_10
DOI: 10.6084/m9.figshare.5104873.v1
专利: US05561101
来源说明: uspto-grants-1996_10

反应 SMILES

[CH3:1][N:2]([C:9]([C:11]1[C:12]([C:27]2[CH:32]=[CH:31][CH:30]=[CH:29][CH:28]=2)=[N:13][O:14][C:15]=1[CH2:16][C:17]1[N:22]=[C:21]([O:23][CH3:24])[CH:20]=[C:19]([O:25][CH3:26])[N:18]=1)=[O:10])[C:3]1[CH:8]=[CH:7][CH:6]=[CH:5][CH:4]=1.C([O:37]O)(C)(C)C>C(#N)C.[CH-]=O.[CH-]=O.[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[Co].[Co+2]>[CH3:1][N:2]([C:9]([C:11]1[C:12]([C:27]2[CH:32]=[CH:31][CH:30]=[CH:29][CH:28]=2)=[N:13][O:14][C:15]=1[C:16]([C:17]1[N:22]=[C:21]([O:23][CH3:24])[CH:20]=[C:19]([O:25][CH3:26])[N:18]=1)=[O:37])=[O:10])[C:3]1[CH:4]=[CH:5][CH:6]=[CH:7][CH:8]=1