HRID2337380

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID702

Ethanol

C2H6O

HCID813

Potassium cation

K+

2 次

HCID962

Water

H2O

HCID1140

Toluene

C7H8

HCID19660

Carbonate

CO3-2

HCID15614003

Ethyl 6-(chloromethyl)pyridine-2-carboxylate

C9H10ClNO2

结构：CC1(C)OB(c2cc(Cl)ccc2OCc2ccc(Cl)cc2F)OC1(C)C

HCID24753688

2-{5-Chloro-2-[(4-chloro-2-fluorophenyl)methoxy]phenyl}-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

C19H20BCl2FO3

PRODUCTS

生成物

结构：CCOC(=O)c1cccc(Cc2cc(Cl)ccc2OCc2ccc(Cl)cc2F)n1

HCID59384237

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-506d64600bd240e6a66a9b0acfc2ae0e
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

[CH3:46][CH2:47][OH:48].[CH3:50][c:51]1[cH:52][cH:53][cH:54][cH:55][cH:56]1.[Cl:1][c:2]1[cH:3][cH:4][c:5]([O:17][CH2:18][c:19]2[c:20]([F:26])[cH:21][c:22]([Cl:25])[cH:23][cH:24]2)[c:6]([B:8]2[O:9][C:10]([CH3:11])([CH3:12])[C:13]([CH3:14])([CH3:15])[O:16]2)[cH:7]1.[Cl:27][CH2:28][c:29]1[cH:30][cH:31][cH:32][c:33]([C:35](=[O:36])[O:37][CH2:38][CH3:39])[n:34]1.[K+:40].[K+:41].[O-:42][C:43]([O-:44])=[O:45].[OH2:49]>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([O:17][CH2:18][c:19]2[c:20]([F:26])[cH:21][c:22]([Cl:25])[cH:23][cH:24]2)[c:6]([CH2:28][c:29]2[cH:30][cH:31][cH:32][c:33]([C:35](=[O:36])[O:37][CH2:38][CH3:39])[n:34]2)[cH:7]1