HRID803236

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID887

Methanol

CH4O

HCID962

Water

H2O

HCID3283

Diethyl Ether

C4H10O

HCID6372

Chlorodifluoromethane

CHClF2

HCID8028

Tetrahydrofuran

C4H8O

HCID16028

Tetrabutylammonium

C16H36N+

HCID30165

Iodide ion

I-

HCID31275

1,4-Dioxane

C4H8O2

结构：COc1ccc(C2=NN(C3CCN(C(=O)c4cc(O)ccc4C)CC3)C(=O)C2(C)C)cc1OC

HCID46202067

未命名化合物

PRODUCTS

生成物

结构：COc1ccc(C2=NN(C3CCN(C(=O)c4cc(OC(F)F)ccc4C)CC3)C(=O)C2(C)C)cc1OC

HCID67365462

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-5a12793fb00a4c5baac4c85dbca2e771
来源数据集: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Test data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[CH2:35]1[O:36][CH2:37][CH2:38][CH2:39]1.[CH2:50]([N+:51]([CH2:52][CH2:53][CH2:54][CH3:55])([CH2:56][CH2:57][CH2:58][CH3:59])[CH2:60][CH2:61][CH2:62][CH3:63])[CH2:64][CH2:65][CH3:66].[CH3:1][O:2][c:3]1[cH:4][c:5]([C:11]2=[N:15][N:14]([CH:16]3[CH2:17][CH2:18][N:19]([C:22](=[O:23])[c:24]4[c:25]([CH3:31])[cH:26][cH:27][c:28]([OH:30])[cH:29]4)[CH2:20][CH2:21]3)[C:13](=[O:32])[C:12]2([CH3:33])[CH3:34])[cH:6][cH:7][c:8]1[O:9][CH3:10].[CH3:44][CH2:45][O:46][CH2:47][CH3:48].[CH3:67][OH:68].[Cl:40][CH:41]([F:42])[F:43].[I-:49].[O:69]1[CH2:70][CH2:71][O:72][CH2:73][CH2:74]1.[OH2:75]>>[CH3:1][O:2][c:3]1[cH:4][c:5]([C:11]2=[N:15][N:14]([CH:16]3[CH2:17][CH2:18][N:19]([C:22](=[O:23])[c:24]4[c:25]([CH3:31])[cH:26][cH:27][c:28]([O:30][CH:41]([F:42])[F:43])[cH:29]4)[CH2:20][CH2:21]3)[C:13](=[O:32])[C:12]2([CH3:33])[CH3:34])[cH:6][cH:7][c:8]1[O:9][CH3:10]