HRID1725154

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID7450

1,3-Diisopropylbenzene

C12H18

$结构：COc1c(C)c2c(c(O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]3O)c1C/C=C(\C)CCC(=O)O)C(=O)OC2$

HCID6442661

Mycophenolic acid glucuronide

C23H28O12

HCID71436539

未命名化合物

PRODUCTS

生成物

HCID7450

1,3-Diisopropylbenzene

C12H18

HCID53471113

未命名化合物

HCID71436539

未命名化合物

PROCEDURE

实验过程

The raw material liquid for oxidation usually contains 20 to 60% by weight of m-diisopropylbenzene monohydroperoxide and 10 to 40% by weight of m-diisopropylbenzene. As usual reaction conditions, a temperature of 70 to 110° C., a pressure of 0 to 1 MPaG, a residence time of about 0.01 to 50 hours and the like are illustrated. As an apparatus used in the oxidation step, for example, a flowing type or batch type reaction vessel or reaction column can be listed. The oxidation reaction mixture obtained in the oxidation step usually contains 3 to 30% by weight of m-diisopropylbenzene dihydroperoxide and 20 to 60% by weight of m-diisopropylbenzene monohydroperoxide and 35% by weight or less of m-diisopropylbenzene.

WORKUP

后处理

customAs usual reaction conditions
customa temperature of 70 to 110° C.
customa residence time of about 0.01 to 50 hours
customa flowing type or batch type reaction vessel or reaction column
customThe oxidation reaction mixture

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-84d300448354445b89e57a2f3dfe2257
来源数据集: uspto-grants-2009_02
DOI: 10.6084/m9.figshare.5104873.v1
专利: US07488853B2
来源说明: uspto-grants-2009_02

反应 SMILES

[O-:1][OH:2].[CH:3]([C:6]1[CH:11]=[CH:10][CH:9]=[C:8]([CH:12]([CH3:14])[CH3:13])[CH:7]=1)([CH3:5])[CH3:4].[CH:15]([C:18]1[CH:23]=[CH:22][CH:21]=[C:20]([CH:24]([CH3:26])[CH3:25])[CH:19]=1)([CH3:17])[CH3:16].CC1C2COC(=O)C=2C(O[C@@H]2O[C@H](C(O)=O)[C@@H](O)[C@H](O)[C@H]2O)=C(C/C=C(/CCC(O)=O)\C)C=1OC>>[O-:1][OH:2].[O-:1][OH:2].[CH:12]([C:8]1[CH:9]=[CH:10][CH:11]=[C:6]([CH:3]([CH3:5])[CH3:4])[CH:7]=1)([CH3:14])[CH3:13].[O-:1][OH:2].[CH:24]([C:20]1[CH:21]=[CH:22][CH:23]=[C:18]([CH:15]([CH3:17])[CH3:16])[CH:19]=1)([CH3:26])[CH3:25].[CH:12]([C:8]1[CH:9]=[CH:10][CH:11]=[C:6]([CH:3]([CH3:5])[CH3:4])[CH:7]=1)([CH3:14])[CH3:13]