HRID2332722

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID1140

Toluene

C7H8

HCID8150

Diethylene glycol dimethyl ether

C6H14O3

HCID8857

Ethyl acetate

C4H8O2

HCID19660

Carbonate

CO3-2

HCID24350

Copper(1+) iodide; Copper(I) iodide; Cuprous iodide; Cuprous iodide (CuI)

CuI

HCID104967

Cesium(1+)

Cs+

2 次

HCID3122513

未命名化合物

HCID58294816

未命名化合物

PRODUCTS

生成物

结构：CC(C)Oc1cc(OCC2C(C)(O)CCC3C(C)(C)CCCC32C)cc(OC(C)C)c1

HCID76744357

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-9ddb9965e56042e1ba6e986ec03028e8
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (10/10)

反应 SMILES

[C:33](=[O:34])([O-:35])[O-:36].[CH3:39][O:40][CH2:41][CH2:42][O:43][CH2:44][CH2:45][O:46][CH3:47].[CH3:48][CH2:49][O:50][C:51]([CH3:52])=[O:53].[CH3:56][c:57]1[cH:58][cH:59][cH:60][cH:61][cH:62]1.[Cs+:37].[Cs+:38].[Cu:54][I:55].[I:1][c:2]1[cH:3][c:4]([O:12][CH:13]([CH3:14])[CH3:15])[cH:5][c:6]([O:8][CH:9]([CH3:10])[CH3:11])[cH:7]1.[OH:16][CH2:17][CH:18]1[C:19]([OH:31])([CH3:32])[CH2:20][CH2:21][CH:22]2[C:23]([CH3:29])([CH3:30])[CH2:24][CH2:25][CH2:26][C:27]12[CH3:28]>>[c:2]1([O:16][CH2:17][CH:18]2[C:19]([OH:31])([CH3:32])[CH2:20][CH2:21][CH:22]3[C:23]([CH3:29])([CH3:30])[CH2:24][CH2:25][CH2:26][C:27]23[CH3:28])[cH:3][c:4]([O:12][CH:13]([CH3:14])[CH3:15])[cH:5][c:6]([O:8][CH:9]([CH3:10])[CH3:11])[cH:7]1