HRID1357381

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID11471072

未命名化合物

结构：COC(=O)c1ccc(Oc2ccc(N)cc2N)cc1C(=O)OC

HCID69994331

未命名化合物

结构：COC(=O)c1ccc(Oc2ccc(NC(=O)c3ccc([N+](=O)[O-])cc3Br)cc2NC(=O)c2ccc([N+](=O)[O-])cc2Br)cc1C(=O)OC

HCID86759062

未命名化合物

2 次

PRODUCTS

生成物

结构：COC(=O)c1cccc(Oc2ccc(NC(=O)c3ccc([N+](=O)[O-])cc3Br)cc2NC(=O)c2ccc([N+](=O)[O-])cc2Br)c1C(=O)OC

HCID86759061

未命名化合物

PROCEDURE

实验过程

4-[2,4-Bis-(2-bromo-4-nitrobenzoylamino)phenoxy]phthalic acid dimethyl ester (Compound 113) from 4-(2,4-diaminophenoxy)phthalic acid dimethyl ester (0.53 g) and 2-bromo-5-nitrobenzoyl chloride (1.0 g). The crude product purified on silica gel column (eluent: methylene chloride:methanol (5:1)) to give 4-([2,4-bis-(2-bromo-4-nitrobenzoylamino)phenoxy]phthalic acid dimethyl ester as brownish crystals (yield: 0.81 g 63%). Mp: 138-142° C. LC/MS: 794 (M+Na), 773 (MH+), 740 (M—OMe). CHN: Calculated: C: 46.66; H: 2.61; N: 7.25; Br: 20.69. Found C: 47.05; H: 2.94; N: 6.85; Br: 20.22.

WORKUP

后处理

customThe crude product purified on silica gel column (eluent: methylene chloride:methanol (5:1))

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-e5c8431455ba40839aea2d315a26eed6
来源数据集: uspto-grants-2003_07
DOI: 10.6084/m9.figshare.5104873.v1
专利: US06590118B1
来源说明: uspto-grants-2003_07

反应 SMILES

COC(=O)C1C(=CC([O:14][C:15]2[CH:20]=[CH:19][C:18]([NH:21][C:22](=[O:33])[C:23]3[CH:28]=[CH:27][C:26]([N+:29]([O-:31])=[O:30])=[CH:25][C:24]=3[Br:32])=[CH:17][C:16]=2[NH:34][C:35](=[O:46])[C:36]2[CH:41]=[CH:40][C:39]([N+:42]([O-:44])=[O:43])=[CH:38][C:37]=2[Br:45])=CC=1)C(OC)=O.[CH3:48][O:49][C:50](=[O:70])[C:51]1[C:52](=[CH:57][C:58](OC2C=CC(N)=CC=2N)=[CH:59][CH:60]=1)[C:53]([O:55][CH3:56])=[O:54].BrC1C=CC([N+]([O-])=O)=CC=1C(Cl)=O>>[CH3:56][O:55][C:53](=[O:54])[C:52]1[C:51](=[C:60]([O:14][C:15]2[CH:20]=[CH:19][C:18]([NH:21][C:22](=[O:33])[C:23]3[CH:28]=[CH:27][C:26]([N+:29]([O-:31])=[O:30])=[CH:25][C:24]=3[Br:32])=[CH:17][C:16]=2[NH:34][C:35](=[O:46])[C:36]2[CH:41]=[CH:40][C:39]([N+:42]([O-:44])=[O:43])=[CH:38][C:37]=2[Br:45])[CH:59]=[CH:58][CH:57]=1)[C:50]([O:49][CH3:48])=[O:70]