HRID1128845

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

2 次

HCID962

Water

H2O

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID7841

Allyl bromide

C3H5Br

HCID19660

Carbonate

CO3-2

结构：C=CCOC(=O)Cc1ccc(-c2ccc(OCc3ccc(C(F)(F)F)c(O)c3C=O)c(F)c2)cc1

HCID86617402

未命名化合物

PRODUCTS

生成物

结构：C=CCOC(=O)Cc1ccc(-c2ccc(OCc3ccc(C(F)(F)F)c(OCC=C)c3C=O)c(F)c2)cc1

HCID86617403

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-43ab64cea709455bbe0ef9059aebde18
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (7/10)

反应 SMILES

[C:1](=[O:2])([O-:3])[O-:4].[CH2:7]([CH:8]=[CH2:9])[Br:10].[CH3:47][N:48]([CH3:49])[CH:50]=[O:51].[F:11][c:12]1[cH:13][c:14](-[c:33]2[cH:34][cH:35][c:36]([CH2:39][C:40](=[O:41])[O:42][CH2:43][CH:44]=[CH2:45])[cH:37][cH:38]2)[cH:15][cH:16][c:17]1[O:18][CH2:19][c:20]1[c:21]([CH:31]=[O:32])[c:22]([OH:30])[c:23]([C:26]([F:27])([F:28])[F:29])[cH:24][cH:25]1.[K+:5].[K+:6].[OH2:46]>>[CH2:7]([CH:8]=[CH2:9])[O:30][c:22]1[c:21]([CH:31]=[O:32])[c:20]([CH2:19][O:18][c:17]2[c:12]([F:11])[cH:13][c:14](-[c:33]3[cH:34][cH:35][c:36]([CH2:39][C:40](=[O:41])[O:42][CH2:43][CH:44]=[CH2:45])[cH:37][cH:38]3)[cH:15][cH:16]2)[cH:25][cH:24][c:23]1[C:26]([F:27])([F:28])[F:29]