HRID156073

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID241

Benzene

C6H6

HCID312

Chloride

Cl-

HCID962

Water

H2O

HCID1049

Pyridine

C5H5N

HCID91658

3-(2,2-Dichloroethenyl)-2,2-dimethylcyclopropanecarboxylic acid

C8H10Cl2O2

HCID12961393

未命名化合物

PRODUCTS

生成物

结构：C=CC(OC(=O)C1C(C=C(Cl)Cl)C1(C)C)c1cccc(Oc2ccccc2)c1

HCID12961392

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-42e5857c4f11410688eebf27a12a9341
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

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