HRID144028

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID962

Water

H2O

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID8028

Tetrahydrofuran

C4H8O

HCID8058

n-Hexane

C6H14

HCID8857

Ethyl acetate

C4H8O2

HCID13035

Piperidine, 2,2,6,6-tetramethyl-

C9H19N

结构：Cc1cc(C2CC2)ccc1C(=O)Nc1cccc(Br)c1C(C)(C)O[SiH2]C(C)(C)C

HCID137328400

未命名化合物

HCID178418339

Butyllithium

C4H9Li

PRODUCTS

生成物

结构：CC(C)(C)[SiH2]OC(C)(C)c1c(Br)cccc1N1C(=O)c2ccc(C3CC3)cc2CC1O

HCID178455418

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-ceed7fd558644837b8ea24be93b1f541
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

[Br:16][c:17]1[c:18]([C:36]([O:37][SiH2:38][C:39]([CH3:40])([CH3:41])[CH3:42])([CH3:43])[CH3:44])[c:19]([NH:23][C:24]([c:25]2[c:26]([CH3:34])[cH:27][c:28]([CH:31]3[CH2:32][CH2:33]3)[cH:29][cH:30]2)=[O:35])[cH:20][cH:21][cH:22]1.[CH2:11]([Li:12])[CH2:13][CH2:14][CH3:15].[CH2:57]1[O:58][CH2:59][CH2:60][CH2:61]1.[CH3:1][C:2]1([CH3:3])[CH2:4][CH2:5][CH2:6][C:7]([CH3:8])([CH3:9])[NH:10]1.[CH3:45][N:46]([CH:47]=[O:48])[CH3:49].[CH3:51][CH2:52][CH2:53][CH2:54][CH2:55][CH3:56].[CH3:63][CH2:64][O:65][C:66]([CH3:67])=[O:68].[ClH:50].[OH2:62]>>[Br:16][c:17]1[c:18]([C:36]([O:37][SiH2:38][C:39]([CH3:40])([CH3:41])[CH3:42])([CH3:43])[CH3:44])[c:19]([N:23]2[C:24](=[O:35])[c:25]3[c:26]([cH:27][c:28]([CH:31]4[CH2:32][CH2:33]4)[cH:29][cH:30]3)[CH2:34][CH:47]2[OH:48])[cH:20][cH:21][cH:22]1