HRID1761260

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

结构：CCCCc1oc2ccc([N+](=O)[O-])cc2c1C(=O)c1ccc(OCCCN(CCCC)CCCC)cc1.Cl

HCID10209257

(2-Butyl-5-nitro-1-benzofuran-3-yl){4-[3-(dibutylamino)propoxy]phenyl}methanone--hydrogen chloride (1/1)

C30H41ClN2O5

PRODUCTS

生成物

结构：CCCCc1oc2ccc([N+](=O)[O-])cc2c1C(=O)c1ccc(OCCCN(CCCC)CCCC)cc1

HCID10209258

2-Butyl-3-(4-(3-(dibutylamino)propoxy)benzoyl)-5-nitrobenzofuran

C30H40N2O5

AUXILIARIES

试剂、催化剂与溶剂

溶剂HCID516892

Sodium Bicarbonate

CHNaO3

PROCEDURE

实验过程

The organic phase, comprising the 2-butyl-3-(4-[3-(dibutylamino)propoxy]benzoyl)-5-nitrobenzofuran hydrochloride thus formed, is subsequently washed 5 times using 600 ml of deionized water. It is washed a sixth time with 600 ml of deionized water comprising 50 g (0.595 mol) of sodium hydrogencarbonate to release the desired compound. The chlorobenzene is removed on a rotary evaporator (bath temperature: 35° C., pressure: 10 mmHg).

WORKUP

后处理

customthus formed
washis subsequently washed 5 times

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-326989a28fe44b1c90a5059f023b1277
来源数据集: uspto-grants-2005_01
DOI: 10.6084/m9.figshare.5104873.v1
专利: US06846936B2
来源说明: uspto-grants-2005_01

反应 SMILES

Cl.[CH2:2]([C:6]1[O:7][C:8]2[CH:35]=[CH:34][C:33]([N+:36]([O-:38])=[O:37])=[CH:32][C:9]=2[C:10]=1[C:11](=[O:31])[C:12]1[CH:17]=[CH:16][C:15]([O:18][CH2:19][CH2:20][CH2:21][N:22]([CH2:27][CH2:28][CH2:29][CH3:30])[CH2:23][CH2:24][CH2:25][CH3:26])=[CH:14][CH:13]=1)[CH2:3][CH2:4][CH3:5].O>C(=O)([O-])O.[Na+]>[CH2:2]([C:6]1[O:7][C:8]2[CH:35]=[CH:34][C:33]([N+:36]([O-:38])=[O:37])=[CH:32][C:9]=2[C:10]=1[C:11](=[O:31])[C:12]1[CH:13]=[CH:14][C:15]([O:18][CH2:19][CH2:20][CH2:21][N:22]([CH2:27][CH2:28][CH2:29][CH3:30])[CH2:23][CH2:24][CH2:25][CH3:26])=[CH:16][CH:17]=1)[CH2:3][CH2:4][CH3:5]