HRID845365

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID242

Benzoate

C7H5O2-

HCID3787187

3,5-di-tert-butyl-4-hydroxybenzoyl chloride

C15H21ClO2

结构：CC(C)(C)c1cc(C(=O)Oc2ccc(Cl)c([N+](=O)[O-])c2)cc(C(C)(C)C)c1O

HCID20131013

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)c1cc(C(=O)OCCC(=O)Oc2ccc(Cl)c([N+](=O)[O-])c2)cc(C(C)(C)C)c1O

HCID20131005

未命名化合物

收率 86%

AUXILIARIES

试剂、催化剂与溶剂

溶剂HCID6344

Dichloromethane

CH2Cl2

PROCEDURE

实验过程

A solution of the benzoate (13.7 g, 55.9 mmole) from (a) and 3,5-di-t-butyl-4-hydroxybenzoyl chloride (15.0 g, 55.9 mmole) in dichloromethane (50 ml) were heated under reflux for 42 hours. The solvent was removed by rotary evaporation, and the residue crystallized from 10% toluene in hexane, to give the product (22.9 g, 86%) as a white solid. m.p. 106°-108° C.

WORKUP

后处理

temperatureunder reflux for 42 hours
customThe solvent was removed by rotary evaporation
customthe residue crystallized from 10% toluene in hexane

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-fa7b7142c1844d36b5313aa177ac3e16
来源数据集: uspto-grants-1988_07
DOI: 10.6084/m9.figshare.5104873.v1
专利: US04758501
来源说明: uspto-grants-1988_07

反应 SMILES

C([O-])(=[O:8])C1C=CC=CC=1.C(C1C=[C:16]([CH:30]=C(C(C)(C)C)C=1O)[C:17]([O:19][C:20]1[CH:25]=[CH:24][C:23]([Cl:26])=[C:22]([N+:27]([O-:29])=[O:28])[CH:21]=1)=[O:18])(C)(C)C.[C:38]([C:42]1[CH:43]=[C:44]([CH:48]=[C:49]([C:52]([CH3:55])([CH3:54])[CH3:53])[C:50]=1[OH:51])[C:45](Cl)=[O:46])([CH3:41])([CH3:40])[CH3:39]>ClCCl>[C:38]([C:42]1[CH:43]=[C:44]([CH:48]=[C:49]([C:52]([CH3:55])([CH3:54])[CH3:53])[C:50]=1[OH:51])[C:45]([O:8][CH2:30][CH2:16][C:17]([O:19][C:20]1[CH:25]=[CH:24][C:23]([Cl:26])=[C:22]([N+:27]([O-:29])=[O:28])[CH:21]=1)=[O:18])=[O:46])([CH3:41])([CH3:40])[CH3:39]