HRID646120

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID11466

1-Bromo-4-nitrobenzene

C6H4BrNO2

HCID14798

Sodium Hydroxide

HNaO

结构：CCOC(=O)c1cc2cc(-c3ccc(C(C)(C)C)cc3)ccc2[nH]1

HCID68475095

未命名化合物

PRODUCTS

生成物

结构：CCOC(=O)c1cc2cc(-c3ccc(C(C)(C)C)cc3)ccc2n1-c1ccc([N+](=O)[O-])cc1

HCID68695069

未命名化合物

结构：CC(C)(C)c1ccc(-c2ccc3c(c2)cc(C(=O)[O-])n3-c2ccc([N+](=O)[O-])cc2)cc1.[Na+]

HCID68701941

未命名化合物

AUXILIARIES

试剂、催化剂与溶剂

溶剂HCID31275

1,4-Dioxane

C4H8O2

PROCEDURE

实验过程

5-(4-tert-Butylphenyl)-1-(4-nitrophenyl)indole-2-carboxylic acid ethyl ester was prepared in accordance with Example 1 using 5-(4-tert-butylphenyl)indole-2-carboxylic acid ethyl ester and 1-bromo-4-nitrobenzene. This ester (207 mg, 0.47 mmol) was dissolved in dioxane (2 mL) to which aqueous NaOH (1M, 1 mL) was added. The mixture was heated using microwave irradiation at 120° C. for 15 min and allowed to cool. The precipitate was filtered off, washed with water and recrystallised from EtOH/EtOAc to yield the title compound.

WORKUP

后处理

additionwas added
temperatureThe mixture was heated
custommicrowave irradiation at 120° C. for 15 min
temperatureto cool
filtrationThe precipitate was filtered off
washwashed with water
customrecrystallised from EtOH/EtOAc

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-6189d39c193b4266b377ce637ba4368b
来源数据集: uspto-grants-2010_04
DOI: 10.6084/m9.figshare.5104873.v1
专利: US07705023B2
来源说明: uspto-grants-2010_04

反应 SMILES

[CH2:1]([O:3][C:4]([C:6]1[NH:7][C:8]2[C:13]([CH:14]=1)=[CH:12][C:11]([C:15]1[CH:20]=[CH:19][C:18]([C:21]([CH3:24])([CH3:23])[CH3:22])=[CH:17][CH:16]=1)=[CH:10][CH:9]=2)=[O:5])[CH3:2].Br[C:26]1[CH:31]=[CH:30][C:29]([N+:32]([O-:34])=[O:33])=[CH:28][CH:27]=1.[OH-].[Na+:36]>O1CCOCC1>[CH2:1]([O:3][C:4]([C:6]1[N:7]([C:26]2[CH:31]=[CH:30][C:29]([N+:32]([O-:34])=[O:33])=[CH:28][CH:27]=2)[C:8]2[C:13]([CH:14]=1)=[CH:12][C:11]([C:15]1[CH:16]=[CH:17][C:18]([C:21]([CH3:23])([CH3:22])[CH3:24])=[CH:19][CH:20]=1)=[CH:10][CH:9]=2)=[O:5])[CH3:2].[C:21]([C:18]1[CH:17]=[CH:16][C:15]([C:11]2[CH:12]=[C:13]3[C:8](=[CH:9][CH:10]=2)[N:7]([C:26]2[CH:31]=[CH:30][C:29]([N+:32]([O-:34])=[O:33])=[CH:28][CH:27]=2)[C:6]([C:4]([O-:3])=[O:5])=[CH:14]3)=[CH:20][CH:19]=1)([CH3:24])([CH3:23])[CH3:22].[Na+:36]