HRID947239

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID7912

Diisopropylamine

C6H15N

HCID8028

Tetrahydrofuran

C4H8O

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

HCID11170993

4-Ethynylbenzyl alcohol

C9H8O

结构：COC(=O)COc1ccc(OCC=C(c2ccc(I)cc2)c2ccc(C(C)(C)C)cc2)cc1C

HCID91566432

未命名化合物

PRODUCTS

生成物

结构：COC(=O)COc1ccc(OCC=C(c2ccc(C#Cc3ccc(CO)cc3)cc2)c2ccc(C(C)(C)C)cc2)cc1C

HCID91225494

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-b332165ca06c44efbd5e97aff7ea9af7
来源数据集: Validation data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Validation data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[C:18]([CH3:19])([CH3:20])([CH3:21])[c:22]1[cH:23][cH:24][c:25]([C:28](=[CH:29][CH2:30][O:31][c:32]2[cH:33][c:34]([CH3:44])[c:35]([O:36][CH2:37][C:38](=[O:39])[O:40][CH3:41])[cH:42][cH:43]2)[c:45]2[cH:46][cH:47][c:48]([I:51])[cH:49][cH:50]2)[cH:26][cH:27]1.[C:1](#[CH:2])[c:3]1[cH:4][cH:5][c:6]([CH2:9][OH:10])[cH:7][cH:8]1.[CH:11]([NH:12][CH:13]([CH3:14])[CH3:15])([CH3:16])[CH3:17].[Cu:57][I:58].[O:52]1[CH2:53][CH2:54][CH2:55][CH2:56]1.[Pd:59]([Cl:60])[Cl:61].[c:62]1([P:63]([c:64]2[cH:65][cH:66][cH:67][cH:68][cH:69]2)[c:70]2[cH:71][cH:72][cH:73][cH:74][cH:75]2)[cH:76][cH:77][cH:78][cH:79][cH:80]1.[c:81]1([P:82]([c:83]2[cH:84][cH:85][cH:86][cH:87][cH:88]2)[c:89]2[cH:90][cH:91][cH:92][cH:93][cH:94]2)[cH:95][cH:96][cH:97][cH:98][cH:99]1>>[C:1](#[C:2][c:48]1[cH:47][cH:46][c:45]([C:28]([c:25]2[cH:24][cH:23][c:22]([C:18]([CH3:19])([CH3:20])[CH3:21])[cH:27][cH:26]2)=[CH:29][CH2:30][O:31][c:32]2[cH:33][c:34]([CH3:44])[c:35]([O:36][CH2:37][C:38](=[O:39])[O:40][CH3:41])[cH:42][cH:43]2)[cH:50][cH:49]1)[c:3]1[cH:4][cH:5][c:6]([CH2:9][OH:10])[cH:7][cH:8]1