HRID2333200

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

HCID961

Hydroxide

HO-

HCID962

Water

H2O

HCID6344

Dichloromethane

CH2Cl2

HCID23938

Palladium

2 次

HCID24404

Phosphine

H3P

HCID31275

1,4-Dioxane

C4H8O2

HCID95417

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

C17H14O

3 次

反应SMILES：CC(C)c1cc(C(C)C)c(-c2ccccc2P(C(C)(C)C)C(C)(C)C)c(C(C)C)c1

HCID11618717

2-Di-tert-butylphosphino-2',4',6'-triisopropylbiphenyl

C29H45P

反应SMILES：Fc1cc(Br)c2ccn(-c3ccc(OCc4ccccc4)cc3)c2c1

HCID59627933

4-Bromo-6-fluoro-1-[4-(phenylmethoxy)phenyl]-1H-indole

C21H15BrFNO

PRODUCTS

产物

反应SMILES：Oc1cc(F)cc2c1ccn2-c1ccc(OCc2ccccc2)cc1

HCID59627924

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-972cda9d75734de6b87fb95355924962
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (10/10)

反应SMILES

[Br:1][c:2]1[c:3]2[cH:4][cH:5][n:6](-[c:12]3[cH:13][cH:14][c:15]([O:18][CH2:19][c:20]4[cH:21][cH:22][cH:23][cH:24][cH:25]4)[cH:16][cH:17]3)[c:7]2[cH:8][c:9]([F:11])[cH:10]1.[CH3:29][C:30]([P:31]([C:32]([CH3:33])([CH3:34])[CH3:35])[c:36]1[cH:37][cH:38][cH:39][cH:40][c:41]1-[c:42]1[c:43]([CH:44]([CH3:45])[CH3:46])[cH:47][c:48]([CH:49]([CH3:50])[CH3:51])[cH:52][c:53]1[CH:54]([CH3:55])[CH3:56])([CH3:57])[CH3:58].[Cl:65][CH2:66][Cl:67].[K+:27].[O:107]=[C:108]([CH:109]=[CH:110][c:111]1[cH:112][cH:113][cH:114][cH:115][cH:116]1)[CH:117]=[CH:118][c:119]1[cH:120][cH:121][cH:122][cH:123][cH:124]1.[O:59]1[CH2:60][CH2:61][O:62][CH2:63][CH2:64]1.[O:71]=[C:72]([CH:73]=[CH:74][c:75]1[cH:76][cH:77][cH:78][cH:79][cH:80]1)[CH:81]=[CH:82][c:83]1[cH:84][cH:85][cH:86][cH:87][cH:88]1.[O:89]=[C:90]([CH:91]=[CH:92][c:93]1[cH:94][cH:95][cH:96][cH:97][cH:98]1)[CH:99]=[CH:100][c:101]1[cH:102][cH:103][cH:104][cH:105][cH:106]1.[OH-:26].[OH2:68].[PH3:28].[Pd:69].[Pd:70]>>[c:2]1([OH:26])[c:3]2[cH:4][cH:5][n:6](-[c:12]3[cH:13][cH:14][c:15]([O:18][CH2:19][c:20]4[cH:21][cH:22][cH:23][cH:24][cH:25]4)[cH:16][cH:17]3)[c:7]2[cH:8][c:9]([F:11])[cH:10]1