HRID1670098

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID2776178

1,4-Benzodioxane-6-boronic acid

C8H9BO4

结构：CCOC(=O)CCCOc1cccc(CCCCCCOc2cc(C(=O)OC(C)(C)C)cc(-c3cscc3C)c2)c1CCC(=O)OCC

HCID67338934

未命名化合物

结构：CCOC(=O)CCCOc1cccc(CCCCCCOc2cc(Br)cc(C(=O)OC(C)(C)C)c2)c1CCC(=O)OCC

HCID67339731

未命名化合物

PRODUCTS

生成物

结构：CCOC(=O)CCCOc1cccc(CCCCCCOc2cc(C(=O)OC(C)(C)C)cc(-c3ccc4c(c3)OCCO4)c2)c1CCC(=O)OCC

HCID67338832

未命名化合物

PROCEDURE

实验过程

The title compound was prepared by the same method as 3-{6-[2-(2-ethoxycarbonyl-ethyl)-3-(3-ethoxycarbonyl-propoxy)-phenyl]-hexyloxy}-5-(4-methyl-thiophen-3-yl)-benzoic acid tert-butyl ester starting from 3-bromo-5-{6-[2-(2-ethoxycarbonyl-ethyl)-3-(3-ethoxycarbonyl-propoxy)-phenyl]-hexyloxy}-benzoic acid tert-butyl ester and 1,4-benzodioxane-6-boronic acid.

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-8da36280ae7f42f4bc0214611417563f
来源数据集: uspto-grants-2011_08
DOI: 10.6084/m9.figshare.5104873.v1
专利: US07989454B2
来源说明: uspto-grants-2011_08

反应 SMILES

[C:1]([O:5][C:6](=[O:48])[C:7]1[CH:12]=[C:11]([C:13]2[C:17](C)=[CH:16]S[CH:14]=2)[CH:10]=[C:9]([O:19][CH2:20][CH2:21][CH2:22][CH2:23][CH2:24][CH2:25][C:26]2[CH:31]=[CH:30][CH:29]=[C:28]([O:32][CH2:33][CH2:34][CH2:35][C:36]([O:38][CH2:39][CH3:40])=[O:37])[C:27]=2[CH2:41][CH2:42][C:43]([O:45][CH2:46][CH3:47])=[O:44])[CH:8]=1)([CH3:4])([CH3:3])[CH3:2].C(OC(=O)C1C=C(OCCCCCCC2C=CC=C(OCCCC(OCC)=O)C=2CCC(OCC)=O)C=C(Br)C=1)(C)(C)C.[O:92]1[C:97]2C=CC(B(O)O)=C[C:96]=2[O:95][CH2:94][CH2:93]1>>[C:1]([O:5][C:6](=[O:48])[C:7]1[CH:8]=[C:9]([O:19][CH2:20][CH2:21][CH2:22][CH2:23][CH2:24][CH2:25][C:26]2[CH:31]=[CH:30][CH:29]=[C:28]([O:32][CH2:33][CH2:34][CH2:35][C:36]([O:38][CH2:39][CH3:40])=[O:37])[C:27]=2[CH2:41][CH2:42][C:43]([O:45][CH2:46][CH3:47])=[O:44])[CH:10]=[C:11]([C:13]2[CH:14]=[CH:94][C:93]3[O:92][CH2:97][CH2:96][O:95][C:16]=3[CH:17]=2)[CH:12]=1)([CH3:4])([CH3:2])[CH3:3]