HRID201797

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

3 次

HCID962

Water

H2O

HCID1061

Phosphate

O4P-3

HCID8071

未命名化合物

HCID8083

Morpholine

C4H9NO

HCID8857

Ethyl acetate

C4H8O2

HCID23938

Palladium

2 次

HCID95417

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

C17H14O

3 次

HCID2734215

2-(Di-tert-butylphosphino)biphenyl

C20H27P

HCID11098384

5-Oxo-5,6,7,8-tetrahydronaphthalen-2-yl trifluoromethanesulfonate

C11H9F3O4S

PRODUCTS

生成物

HCID13179501

6-(Morpholin-4-yl)-3,4-dihydronaphthalen-1(2H)-one

C14H17NO2

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-160787a290d8422e9531b3aebe09b16d
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

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