HRID301093

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

2 次

HCID7237

o-Xylene

C8H10

HCID19660

Carbonate

CO3-2

HCID62652

未命名化合物

HCID70943

4,6-Dichloropyrimidine

C4H2Cl2N2

HCID112414

Ethanamine, 2-(2-methoxyethoxy)-N,N-bis[2-(2-methoxyethoxy)ethyl]-

C15H33NO6

结构：O=C(c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCC2(CC1)C(=O)NCN2c1ccccc1

HCID18401725

未命名化合物

PRODUCTS

生成物

结构：O=C(c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCC2(CC1)C(=O)N(c1cc(Cl)ncn1)CN2c1ccccc1

HCID18401681

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-f9f8b4ed316a4d84a09fece538c94f8c
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

[C:34](=[O:35])([O-:36])[O-:37].[CH3:40][O:41][CH2:42][CH2:43][O:44][CH2:45][CH2:46][N:47]([CH2:48][CH2:49][O:50][CH2:51][CH2:52][O:53][CH3:54])[CH2:55][CH2:56][O:57][CH2:58][CH2:59][O:60][CH3:61].[Cl:62][c:63]1[n:64][cH:65][n:66][c:67]([Cl:69])[cH:68]1.[Cu:78][Cl:79].[F:1][C:2]([c:3]1[cH:4][c:5]([C:6](=[O:7])[N:8]2[CH2:9][CH2:10][C:11]3([C:12](=[O:22])[NH:13][CH2:14][N:15]3[c:16]3[cH:17][cH:18][cH:19][cH:20][cH:21]3)[CH2:23][CH2:24]2)[cH:25][c:26]([C:28]([F:29])([F:30])[F:31])[cH:27]1)([F:32])[F:33].[K+:38].[K+:39].[c:70]1([CH3:71])[c:72]([CH3:73])[cH:74][cH:75][cH:76][cH:77]1>>[F:1][C:2]([c:3]1[cH:4][c:5]([C:6](=[O:7])[N:8]2[CH2:9][CH2:10][C:11]3([C:12](=[O:22])[N:13]([c:67]4[n:66][cH:65][n:64][c:63]([Cl:62])[cH:68]4)[CH2:14][N:15]3[c:16]3[cH:17][cH:18][cH:19][cH:20][cH:21]3)[CH2:23][CH2:24]2)[cH:25][c:26]([C:28]([F:29])([F:30])[F:31])[cH:27]1)([F:32])[F:33]