HRID296472

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID174

Ethylene glycol

C2H6O2

HCID923

Sodium ion

Na+

2 次

HCID962

Water

H2O

HCID1118

Sulfuric acid

H2O4S

HCID11776

Triphenylphosphine

C18H15P

2 次

HCID19660

Carbonate

CO3-2

HCID24290

未命名化合物

HCID816730

未命名化合物

HCID4684888

4-Pentyloxyphenylboronic acid

C11H17BO3

PRODUCTS

生成物

结构：CCCCCOc1ccc(-c2ccc(-c3ccc(C(=O)O)cc3)cc2)cc1

HCID9798987

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-c070f4decbf743ca9552a21567d937da
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

[CH2:17]([CH2:18][CH2:19][CH2:20][CH3:21])[O:22][c:23]1[cH:24][cH:25][c:26]([B:29]([OH:30])[OH:31])[cH:27][cH:28]1.[I:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[cH:9][cH:10][c:11]([C:14](=[O:15])[OH:16])[cH:12][cH:13]2)[cH:6][cH:7]1.[Na+:32].[Na+:33].[O-:34][C:35](=[O:36])[O-:37].[OH2:84].[OH:85][CH2:86][CH2:87][OH:88].[Pd:43]([Cl:44])[Cl:45].[S:38](=[O:39])(=[O:40])([OH:41])[OH:42].[c:46]1([P:47]([c:48]2[cH:49][cH:50][cH:51][cH:52][cH:53]2)[c:54]2[cH:55][cH:56][cH:57][cH:58][cH:59]2)[cH:60][cH:61][cH:62][cH:63][cH:64]1.[c:65]1([P:66]([c:67]2[cH:68][cH:69][cH:70][cH:71][cH:72]2)[c:73]2[cH:74][cH:75][cH:76][cH:77][cH:78]2)[cH:79][cH:80][cH:81][cH:82][cH:83]1>>[c:2]1(-[c:26]2[cH:25][cH:24][c:23]([O:22][CH2:17][CH2:18][CH2:19][CH2:20][CH3:21])[cH:28][cH:27]2)[cH:3][cH:4][c:5](-[c:8]2[cH:9][cH:10][c:11]([C:14](=[O:15])[OH:16])[cH:12][cH:13]2)[cH:6][cH:7]1