HRID817711

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID263

1-Butanol

C4H10O

HCID813

Potassium cation

K+

3 次

HCID1061

Phosphate

O4P-3

HCID23938

Palladium

2 次

HCID95417

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

C17H14O

3 次

HCID2773526

4-(N-Methylaminocarbonyl)phenylboronic acid

C8H10BNO3

HCID7018040

4-Bromo-2-fluoro-5-methylaniline

C7H7BrFN

结构：COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1

HCID11269872

2-Dicyclohexylphosphino-2′,6′-dimethoxybiphenyl

C26H35O2P

PRODUCTS

生成物

HCID59586805

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-004990944c154ff6ac58ca00d10d2543
来源数据集: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Test data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[Br:1][c:2]1[cH:3][c:4]([F:10])[c:5]([NH2:6])[cH:7][c:8]1[CH3:9].[CH2:61]([OH:62])[CH2:63][CH2:64][CH3:65].[CH3:11][NH:12][C:13](=[O:14])[c:15]1[cH:16][cH:17][c:18]([B:21]([OH:22])[OH:23])[cH:19][cH:20]1.[CH:24]1([P:25]([CH:26]2[CH2:27][CH2:28][CH2:29][CH2:30][CH2:31]2)[c:32]2[cH:33][cH:34][cH:35][cH:36][c:37]2-[c:38]2[c:39]([O:40][CH3:41])[cH:42][cH:43][cH:44][c:45]2[O:46][CH3:47])[CH2:48][CH2:49][CH2:50][CH2:51][CH2:52]1.[K+:58].[K+:59].[K+:60].[O:104]=[C:105]([CH:106]=[CH:107][c:108]1[cH:109][cH:110][cH:111][cH:112][cH:113]1)[CH:114]=[CH:115][c:116]1[cH:117][cH:118][cH:119][cH:120][cH:121]1.[O:68]=[C:69]([CH:70]=[CH:71][c:72]1[cH:73][cH:74][cH:75][cH:76][cH:77]1)[CH:78]=[CH:79][c:80]1[cH:81][cH:82][cH:83][cH:84][cH:85]1.[O:86]=[C:87]([CH:88]=[CH:89][c:90]1[cH:91][cH:92][cH:93][cH:94][cH:95]1)[CH:96]=[CH:97][c:98]1[cH:99][cH:100][cH:101][cH:102][cH:103]1.[P:53]([O-:54])([O-:55])([O-:56])=[O:57].[Pd:66].[Pd:67]>>[c:2]1(-[c:18]2[cH:17][cH:16][c:15]([C:13]([NH:12][CH3:11])=[O:14])[cH:20][cH:19]2)[cH:3][c:4]([F:10])[c:5]([NH2:6])[cH:7][c:8]1[CH3:9]