HRID190726

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID3283

Diethyl Ether

C4H10O

HCID8028

Tetrahydrofuran

C4H8O

HCID8058

n-Hexane

C6H14

HCID8653

4-Chlorobenzophenone

C13H9ClO

HCID14795908

未命名化合物

HCID178418339

未命名化合物

PRODUCTS

生成物

结构：OC(c1ccccc1)(c1ccc(Cl)cc1)c1nccn1COCc1ccccc1

HCID12433915

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-1618bf1a38f24d3f92e558298a47cb3b
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

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