HRID138027

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID9602

Benzene, 1-(chloromethyl)-4-fluoro-

C7H6ClF

HCID3513851

BEMP phosphazene

C13H31N4P

结构：COc1cccc(-c2nc3ncc(-c4ccccc4)cc3[nH]2)c1

HCID9948304

未命名化合物

PRODUCTS

生成物

结构：COc1cccc(-c2nc3ncc(-c4ccccc4)cc3n2Cc2ccc(F)cc2)c1

HCID23026121

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-c0288dba9693452fa9980eaef3ba9e25
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

[C:24]([N:25]=[P:26]1([N:27]([CH2:28][CH3:29])[CH2:30][CH3:31])[N:32]([CH3:33])[CH2:34][CH2:35][CH2:36][N:37]1[CH3:38])([CH3:39])([CH3:40])[CH3:41].[CH3:1][O:2][c:3]1[cH:4][c:5](-[c:9]2[nH:10][c:11]3[c:12]([n:13][cH:14][c:15](-[c:17]4[cH:18][cH:19][cH:20][cH:21][cH:22]4)[cH:16]3)[n:23]2)[cH:6][cH:7][cH:8]1.[CH:51]([N:52]([CH3:53])[CH3:54])=[O:55].[F:42][c:43]1[cH:44][cH:45][c:46]([CH2:47][Cl:48])[cH:49][cH:50]1>>[CH3:1][O:2][c:3]1[cH:4][c:5](-[c:9]2[n:10]([CH2:47][c:46]3[cH:45][cH:44][c:43]([F:42])[cH:50][cH:49]3)[c:11]3[c:12]([n:13][cH:14][c:15](-[c:17]4[cH:18][cH:19][cH:20][cH:21][cH:22]4)[cH:16]3)[n:23]2)[cH:6][cH:7][cH:8]1