HRID2135228

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID8258

2-Methyl-3-butyn-2-ol

C5H8O

HCID8471

Triethylamine

C6H15N

HCID11776

Triphenylphosphine

C18H15P

2 次

HCID24290

未命名化合物

HCID10755376

2-(4-Bromophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

C12H16BBrO2

PRODUCTS

生成物

结构：CC(C)(O)C#Cc1ccc(B2OC(C)(C)C(C)(C)O2)cc1

HCID59558341

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-b605254dfb014756b2fb48b0a013ff9f
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (4/10)

反应 SMILES

[Br:7][c:8]1[cH:9][cH:10][c:11]([B:14]2[O:15][C:16]([CH3:21])([CH3:22])[C:17]([CH3:19])([CH3:20])[O:18]2)[cH:12][cH:13]1.[CH3:1][C:2]([CH3:3])([C:4]#[CH:5])[OH:6].[CH3:23][CH2:24][N:25]([CH2:26][CH3:27])[CH2:28][CH3:29].[O:30]=[CH:31][N:32]([CH3:33])[CH3:34].[Pd:35]([Cl:36])[Cl:37].[c:38]1([P:39]([c:40]2[cH:41][cH:42][cH:43][cH:44][cH:45]2)[c:46]2[cH:47][cH:48][cH:49][cH:50][cH:51]2)[cH:52][cH:53][cH:54][cH:55][cH:56]1.[c:57]1([P:58]([c:59]2[cH:60][cH:61][cH:62][cH:63][cH:64]2)[c:65]2[cH:66][cH:67][cH:68][cH:69][cH:70]2)[cH:71][cH:72][cH:73][cH:74][cH:75]1>>[CH3:1][C:2]([CH3:3])([C:4]#[C:5][c:8]1[cH:9][cH:10][c:11]([B:14]2[O:15][C:16]([CH3:21])([CH3:22])[C:17]([CH3:19])([CH3:20])[O:18]2)[cH:12][cH:13]1)[OH:6]