HRID834464

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID702

Ethanol

C2H6O

HCID923

Sodium ion

Na+

HCID961

Hydroxide

HO-

HCID962

Water

H2O

HCID8471

Triethylamine

C6H15N

HCID8857

Ethyl acetate

C4H8O2

HCID11776

Triphenylphosphine

C18H15P

2 次

HCID24290

未命名化合物

HCID24350

Copper(1+) iodide; Copper(I) iodide; Cuprous iodide; Cuprous iodide (CuI)

CuI

HCID96882

4-Bromo-4'-fluoro-1,1'-biphenyl

C12H8BrF

HCID3613517

3-ethynyl-3-quinuclidinol

C9H13NO

PRODUCTS

生成物

结构：OC1(C#Cc2ccc(-c3ccc(F)cc3)cc2)CN2CCC1CC2

HCID19077553

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-daf41abacd2642119a996e0b348ac9cf
来源数据集: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Test data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[Br:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[cH:9][cH:10][c:11]([F:14])[cH:12][cH:13]2)[cH:6][cH:7]1.[C:15](#[CH:16])[C:17]1([OH:25])[CH2:18][N:19]2[CH2:20][CH2:21][CH:22]1[CH2:23][CH2:24]2.[CH3:26][CH2:27][OH:28].[CH3:29][CH2:30][N:31]([CH2:32][CH3:33])[CH2:34][CH3:35].[CH3:39][CH2:40][O:41][C:42](=[O:43])[CH3:44].[Cu:86][I:87].[Na+:38].[OH-:37].[OH2:36].[Pd:45]([Cl:46])[Cl:47].[c:48]1([P:49]([c:50]2[cH:51][cH:52][cH:53][cH:54][cH:55]2)[c:56]2[cH:57][cH:58][cH:59][cH:60][cH:61]2)[cH:62][cH:63][cH:64][cH:65][cH:66]1.[c:67]1([P:68]([c:69]2[cH:70][cH:71][cH:72][cH:73][cH:74]2)[c:75]2[cH:76][cH:77][cH:78][cH:79][cH:80]2)[cH:81][cH:82][cH:83][cH:84][cH:85]1>>[c:2]1([C:16]#[C:15][C:17]2([OH:25])[CH2:18][N:19]3[CH2:20][CH2:21][CH:22]2[CH2:23][CH2:24]3)[cH:3][cH:4][c:5](-[c:8]2[cH:9][cH:10][c:11]([F:14])[cH:12][cH:13]2)[cH:6][cH:7]1