HRID1114764

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID6422

未命名化合物

HCID8857

Ethyl acetate

C4H8O2

HCID12052

Silane, triethyl-

C6H16Si

结构：CCCCCCC(O)(c1ccc(C(=O)OC)cc1)c1ccc(OC)c(Br)c1

HCID67341991

未命名化合物

PRODUCTS

生成物

结构：CCCCCC=C(c1ccc(C(=O)OC)cc1)c1ccc(OC)c(Br)c1

HCID67341904

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-8298f6953e484a26a2e05195e03cd13d
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

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