HRID1135972

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8028

Tetrahydrofuran

C4H8O

HCID21986458

Ethyl (4-hydroxy-2-methylphenoxy)acetate

C11H14O4

结构：CCCCCC(O)c1cccc(-c2ccc(C(F)(F)F)cc2)n1

HCID58629879

未命名化合物

PRODUCTS

生成物

结构：CCCCCC(Oc1ccc(OCC(=O)OCC)c(C)c1)c1cccc(-c2ccc(C(F)(F)F)cc2)n1

HCID58629912

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-7b32e4efc304430880a3d98ebfc57328
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

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