HRID143880

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID6342

Acetonitrile

C2H3N

HCID8857

Ethyl acetate

C4H8O2

HCID19660

Carbonate

CO3-2

HCID104967

Cesium(1+)

Cs+

2 次

HCID3608067

(2-Bromoethoxy)-tert-butyldimethylsilane

C8H19BrOSi

HCID57812229

未命名化合物

PRODUCTS

生成物

结构：CC1(C)OB(c2cnn(C3CCN(CCO[Si](C)(C)C(C)(C)C)CC3)c2)OC1(C)C

HCID59402325

1-[2-[[(1,1-Dimethylethyl)dimethylsilyl]oxy]ethyl]-4-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazol-1-yl]piperidine

C22H42BN3O3Si

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-c36ccbb85f4c44ada19c0bec85fce4ef
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:22][CH2:23][CH2:24][O:25][Si:26]([CH3:27])([CH3:28])[C:29]([CH3:30])([CH3:31])[CH3:32].[C:33](=[O:34])([O-:35])[O-:36].[CH3:1][C:2]1([CH3:20])[O:3][B:4]([c:9]2[cH:10][n:11][n:12]([CH:14]3[CH2:15][CH2:16][NH:17][CH2:18][CH2:19]3)[cH:13]2)[O:5][C:6]1([CH3:7])[CH3:8].[CH3:39][C:40]#[N:41].[CH3:42][CH2:43][O:44][C:45](=[O:46])[CH3:47].[ClH:21].[Cs+:37].[Cs+:38]>>[CH3:1][C:2]1([CH3:20])[O:3][B:4]([c:9]2[cH:10][n:11][n:12]([CH:14]3[CH2:15][CH2:16][N:17]([CH2:23][CH2:24][O:25][Si:26]([CH3:27])([CH3:28])[C:29]([CH3:30])([CH3:31])[CH3:32])[CH2:18][CH2:19]3)[cH:13]2)[O:5][C:6]1([CH3:7])[CH3:8]