HRID292963

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID311

Citric acid

C6H8O7

HCID813

Potassium cation

K+

2 次

HCID962

Water

H2O

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID19660

Carbonate

CO3-2

HCID517981

Methyl 3-(bromomethyl)benzoate

C9H9BrO2

HCID612496

3-Bromo-5-ethoxy-4-hydroxybenzaldehyde

C9H9BrO3

PRODUCTS

生成物

结构：CCOc1cc(C=O)cc(Br)c1OCc1cccc(C(=O)OC)c1

HCID86624408

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-24cf751a1e2f4f24aa6c974a902a4f4e
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

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