HRID105323

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

2 次

HCID962

Water

H2O

HCID12679

Hexamethylphosphoramide

C6H18N3OP

HCID19660

Carbonate

CO3-2

HCID97826

2-Propenoic acid, 3-(4-aminophenyl)-, ethyl ester

C11H13NO2

HCID12797298

未命名化合物

PRODUCTS

生成物

结构：CCOC(=O)C=Cc1ccc(NCCCCCCCCCCCCCCCC(F)(F)F)cc1

HCID54517974

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-49208a21d5af4191980433b232774835
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

[C:35](=[O:36])([O-:37])[O-:38].[CH3:41][N:42]([P:43]([N:44]([CH3:45])[CH3:46])([N:47]([CH3:48])[CH3:49])=[O:50])[CH3:51].[F:15][C:16]([CH2:17][CH2:18][CH2:19][CH2:20][CH2:21][CH2:22][CH2:23][CH2:24][CH2:25][CH2:26][CH2:27][CH2:28][CH2:29][CH2:30][CH2:31][Br:32])([F:33])[F:34].[K+:39].[K+:40].[NH2:1][c:2]1[cH:3][cH:4][c:5]([CH:6]=[CH:7][C:8](=[O:9])[O:10][CH2:11][CH3:12])[cH:13][cH:14]1.[OH2:52]>>[NH:1]([c:2]1[cH:3][cH:4][c:5]([CH:6]=[CH:7][C:8](=[O:9])[O:10][CH2:11][CH3:12])[cH:13][cH:14]1)[CH2:31][CH2:30][CH2:29][CH2:28][CH2:27][CH2:26][CH2:25][CH2:24][CH2:23][CH2:22][CH2:21][CH2:20][CH2:19][CH2:18][CH2:17][C:16]([F:15])([F:33])[F:34]