HRID702580

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

HCID962

Water

H2O

HCID6212

Chloroform

CHCl3

HCID6333

Bromochloromethane

CH2BrCl

HCID8857

Ethyl acetate

C4H8O2

HCID16028

Tetrabutylammonium

C16H36N+

HCID18420125

3-[(Benzyloxy)carbonyl]benzoate

C15H11O4-

PRODUCTS

生成物

HCID20454387

Benzyl chloromethyl benzene-1,3-dicarboxylate

C16H13ClO4

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-f429d5bcd79c4ecabfd727f469829303
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应 SMILES

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