HRID942847

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8028

Tetrahydrofuran

C4H8O

HCID75555

未命名化合物

HCID16756990

Ethyl 2-(4-hydroxy-2-methylphenoxy)-2-methylpropanoate

C13H18O4

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

HCID58629822

未命名化合物

PRODUCTS

生成物

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

HCID69207846

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-76fae5faad0c466c9a37e7ad3d10ed1b
来源数据集: Validation data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Validation data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[CH2:54]1[O:55][CH2:56][CH2:57][CH2:58]1.[F:15][C:16]([c:17]1[cH:18][cH:19][c:20](-[c:23]2[cH:24][cH:25][cH:26][c:27]([CH:29]([CH2:30][CH2:31][CH2:32][CH3:33])[OH:34])[n:28]2)[cH:21][cH:22]1)([F:35])[F:36].[O:1]=[C:2]([O:3][CH:4]([CH3:5])[CH3:6])[N:7]=[N:8][C:9]([O:10][CH:11]([CH3:12])[CH3:13])=[O:14].[OH:37][c:38]1[cH:39][c:40]([CH3:53])[c:41]([O:42][C:43]([C:44](=[O:45])[O:46][CH2:47][CH3:48])([CH3:49])[CH3:50])[cH:51][cH:52]1>>[F:15][C:16]([c:17]1[cH:18][cH:19][c:20](-[c:23]2[cH:24][cH:25][cH:26][c:27]([CH:29]([CH2:30][CH2:31][CH2:32][CH3:33])[O:34][c:38]3[cH:39][c:40]([CH3:53])[c:41]([O:42][C:43]([C:44](=[O:45])[O:46][CH2:47][CH3:48])([CH3:49])[CH3:50])[cH:51][cH:52]3)[n:28]2)[cH:21][cH:22]1)([F:35])[F:36]