HRID208727

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8471

Triethylamine

C6H15N

HCID83717

Copper iodide (CuI2)

CuI2

HCID2778497

1-(difluoromethoxy)-4-ethynylbenzene

C9H6F2O

HCID59790338

未命名化合物

结构：c1ccc([PH](c2ccccc2)(c2ccccc2)[Pd]([PH](c2ccccc2)(c2ccccc2)c2ccccc2)([PH](c2ccccc2)(c2ccccc2)c2ccccc2)[PH](c2ccccc2)(c2ccccc2)c2ccccc2)cc1

HCID178420554

未命名化合物

PRODUCTS

生成物

结构：CCOC(=O)C=C1CC(c2cccc(C#Cc3ccc(OC(F)F)cc3)c2)C1

HCID59305309

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-412c9d50313f4e749fc2c64b3f6a5071
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

[CH2:13]([CH3:14])[O:15][C:16]([CH:17]=[C:18]1[CH2:19][CH:20]([c:22]2[cH:23][c:24]([Br:28])[cH:25][cH:26][cH:27]2)[CH2:21]1)=[O:29].[CH3:30][CH2:31][N:32]([CH2:33][CH3:34])[CH2:35][CH3:36].[Cu:37]([I:38])[I:39].[F:1][CH:2]([O:3][c:4]1[cH:5][cH:6][c:7]([C:10]#[CH:11])[cH:8][cH:9]1)[F:12].[cH:40]1[cH:41][cH:42][c:43]([P:44]([Pd:45]([P:46]([c:47]2[cH:48][cH:49][cH:50][cH:51][cH:52]2)([c:53]2[cH:54][cH:55][cH:56][cH:57][cH:58]2)[c:59]2[cH:60][cH:61][cH:62][cH:63][cH:64]2)([P:65]([c:66]2[cH:67][cH:68][cH:69][cH:70][cH:71]2)([c:72]2[cH:73][cH:74][cH:75][cH:76][cH:77]2)[c:78]2[cH:79][cH:80][cH:81][cH:82][cH:83]2)[P:84]([c:85]2[cH:86][cH:87][cH:88][cH:89][cH:90]2)([c:91]2[cH:92][cH:93][cH:94][cH:95][cH:96]2)[c:97]2[cH:98][cH:99][cH:100][cH:101][cH:102]2)([c:103]2[cH:104][cH:105][cH:106][cH:107][cH:108]2)[c:109]2[cH:110][cH:111][cH:112][cH:113][cH:114]2)[cH:115][cH:116]1>>[F:1][CH:2]([O:3][c:4]1[cH:5][cH:6][c:7]([C:10]#[C:11][c:24]2[cH:23][c:22]([CH:20]3[CH2:19][C:18](=[CH:17][C:16]([O:15][CH2:13][CH3:14])=[O:29])[CH2:21]3)[cH:27][cH:26][cH:25]2)[cH:8][cH:9]1)[F:12]