HRID2128680

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID19660

Carbonate

CO3-2

HCID23938

Palladium

2 次

HCID31275

1,4-Dioxane

C4H8O2

HCID95417

1,5-Diphenyl-1,4-pentadien-3-one

C17H14O

3 次

HCID104967

Cesium(1+)

Cs+

2 次

HCID11470330

(3,5-Di-tert-butylphenyl)boronic acid

C14H23BO2

HCID23115454

4-Bromo-2,5-dimethyl-1H-indene

C11H11Br

PRODUCTS

生成物

结构：CC1=Cc2c(ccc(C)c2-c2cc(C(C)(C)C)cc(C(C)(C)C)c2)C1

HCID21071966

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-b68861fd693b49b586e2374c47c22c09
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:24][c:25]1[c:26]2[c:30]([cH:31][cH:32][c:33]1[CH3:34])[CH2:29][C:28]([CH3:35])=[CH:27]2.[C:18](=[O:19])([O-:20])[O-:21].[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][c:7]([B:15]([OH:16])[OH:17])[cH:8][c:9]([C:11]([CH3:12])([CH3:13])[CH3:14])[cH:10]1.[CH2:36]1[O:37][CH2:38][CH2:39][O:40][CH2:41]1.[Cs+:22].[Cs+:23].[O:44]=[C:45]([CH:46]=[CH:47][c:48]1[cH:49][cH:50][cH:51][cH:52][cH:53]1)[CH:54]=[CH:55][c:56]1[cH:57][cH:58][cH:59][cH:60][cH:61]1.[O:62]=[C:63]([CH:64]=[CH:65][c:66]1[cH:67][cH:68][cH:69][cH:70][cH:71]1)[CH:72]=[CH:73][c:74]1[cH:75][cH:76][cH:77][cH:78][cH:79]1.[O:80]=[C:81]([CH:82]=[CH:83][c:84]1[cH:85][cH:86][cH:87][cH:88][cH:89]1)[CH:90]=[CH:91][c:92]1[cH:93][cH:94][cH:95][cH:96][cH:97]1.[Pd:42].[Pd:43]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][c:7](-[c:25]2[c:26]3[c:30]([cH:31][cH:32][c:33]2[CH3:34])[CH2:29][C:28]([CH3:35])=[CH:27]3)[cH:8][c:9]([C:11]([CH3:12])([CH3:13])[CH3:14])[cH:10]1