HRID94357

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID3283

Diethyl Ether

C4H10O

HCID3776

Isopropanol

C3H8O

HCID8028

Tetrahydrofuran

C4H8O

HCID8037

N,N,N',N'-Tetramethylethylenediamine

C6H16N2

HCID88359

1-(Methoxymethyl)-1H-imidazole

C5H8N2O

HCID22352856

Bis(2,4-dichlorophenyl)methanone

C13H6Cl4O

HCID178418339

未命名化合物

PRODUCTS

生成物

结构：COCn1ccnc1C(O)(c1ccc(Cl)cc1Cl)c1ccc(Cl)cc1Cl

HCID12433909

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-d0e82989c40b48dd84994c406ed2de11
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

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