HRID1553380

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8028

Tetrahydrofuran

C4H8O

结构：CC(C)(C)c1ccc(-c2ccc(C(C)(C)C)cc2)cc1

HCID74195

4,4'-Di-tert-butylbiphenyl

C20H26

结构：O=Cc1cc2[nH]cnc2c(F)c1Nc1ccc(Br)cc1Cl

HCID11245608

未命名化合物

HCID178506881

未命名化合物

PRODUCTS

生成物

结构：CCOCC(O)c1cc2[nH]cnc2c(F)c1Nc1ccc(Br)cc1Cl

HCID21114164

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-58ec549a64f5406c9554c9c7b7be13ad
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (1/10)

反应 SMILES

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