HRID106493

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID7726

4-Chlorobenzaldehyde

C7H5ClO

HCID8028

Tetrahydrofuran

C4H8O

结构：Cc1nccn1C(c1ccccc1)(c1ccccc1)c1ccccc1

HCID618246

2-methyl-1-tritylimidazole

C23H20N2

HCID178418339

Butyllithium

C4H9Li

PRODUCTS

生成物

结构：OC(Cc1nccn1C(c1ccccc1)(c1ccccc1)c1ccccc1)c1ccc(Cl)cc1

HCID57750313

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-9b61e0d33cd148e09e2e0697078eb808
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

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