HRID200700

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID8028

Tetrahydrofuran

C4H8O

HCID8037

N,N,N',N'-Tetramethylethylenediamine

C6H16N2

HCID88359

1-(Methoxymethyl)-1H-imidazole

C5H8N2O

结构：O=C(c1ccc(C(F)(F)F)cc1)c1ccc(C(F)(F)F)cc1

HCID519838

未命名化合物

HCID178418339

未命名化合物

PRODUCTS

生成物

结构：COCn1ccnc1C(O)(c1ccc(C(F)(F)F)cc1)c1ccc(C(F)(F)F)cc1

HCID12433899

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-e4c600244f0f4993b7e03b26750b8884
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

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