HRID1491603

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6598

Dimethylcarbamoyl chloride

C3H6ClNO

HCID27871

Dimethylthiocarbamoyl chloride

C3H6ClNS

HCID115223

1-(4-Ethynylphenyl)-4-propyl-2,6,7-trioxabicyclo(2.2.2)octane

C16H18O3

PRODUCTS

生成物

结构：CCCC12COC(c3ccc(C#CC(=O)N(C)C)cc3)(OC1)OC2

HCID15021991

未命名化合物

结构：CCCC12COC(c3ccc(C#CC(=S)N(C)C)cc3)(OC1)OC2

HCID15021992

未命名化合物

PROCEDURE

实验过程

N,N-Dimethyl-3-[4-(4-n-propyl-2,6,7-trioxabicyclo[2,2,2]oct-1-yl)phenyl]-prop-2-ynamide and N,N-dimethyl-3-[4-(4-n-propyl-2,6,7-trioxabicyclo[2,2,2]oct-1-yl)phenyl]-prop-2-ynthioamide were prepared using similar methodology from 1-(4-ethynylphenyl)-4-n-propyl-2,6,7-trioxabicyclo[2,2,2]octane and dimethylcarbamoyl chloride and dimethylthiocarbamoyl chloride respectively.

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-678172f116534cc5a20bfc6f4d692879
来源数据集: uspto-grants-1994_12
DOI: 10.6084/m9.figshare.5104873.v1
专利: US05371075
来源说明: uspto-grants-1994_12

反应 SMILES

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