HRID209029

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID6344

Dichloromethane

CH2Cl2

HCID8471

Triethylamine

C6H15N

HCID74372

Benzoyl chloride, 4-(1,1-dimethylethyl)-

C11H13ClO

HCID46738005

2-Methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)aniline

C13H20BNO2

PRODUCTS

生成物

结构：Cc1c(NC(=O)c2ccc(C(C)(C)C)cc2)cccc1B1OC(C)(C)C(C)(C)O1

HCID58728993

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-580c405ee4244a15ae8f44ff11761693
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][cH:7][c:8]([C:9](=[O:10])[Cl:11])[cH:12][cH:13]1.[CH3:14][c:15]1[c:16]([NH2:30])[cH:17][cH:18][cH:19][c:20]1[B:21]1[O:22][C:23]([CH3:28])([CH3:29])[C:24]([CH3:26])([CH3:27])[O:25]1.[CH3:31][CH2:32][N:33]([CH2:34][CH3:35])[CH2:36][CH3:37].[Cl:39][CH2:40][Cl:41].[OH2:38]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][cH:7][c:8]([C:9](=[O:10])[NH:30][c:16]2[c:15]([CH3:14])[c:20]([B:21]3[O:22][C:23]([CH3:28])([CH3:29])[C:24]([CH3:26])([CH3:27])[O:25]3)[cH:19][cH:18][cH:17]2)[cH:12][cH:13]1