HRID955823

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID702

Ethanol

C2H6O

HCID813

Potassium cation

K+

HCID923

Sodium ion

Na+

HCID962

Water

H2O

HCID8028

Tetrahydrofuran

C4H8O

HCID23938

Palladium

2 次

HCID28123

Borohydride

BH4-

HCID28179

Fluoride

F-

HCID83681

Tris(1,1-dimethylethyl)phosphine

C12H27P

HCID95417

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

C17H14O

3 次

HCID2734336

2,6-Difluorophenylboronic acid

C6H5BF2O2

HCID24820318

2-Bromo-3-fluoro-6-methylpyridine

C6H5BrFN

PRODUCTS

产物

HCID59226508

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-e30a4ae16ed04bf79649e897e4cee97b
来源数据集: Validation data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Validation data from https://doi.org/10.1039/C8SC04228D

反应SMILES

[BH4-:36].[Br:1][c:2]1[n:3][c:4]([CH3:9])[cH:5][cH:6][c:7]1[F:8].[C:23]([P:24]([C:25]([CH3:26])([CH3:27])[CH3:28])[C:29]([CH3:30])([CH3:31])[CH3:32])([CH3:33])([CH3:34])[CH3:35].[CH2:38]1[O:39][CH2:40][CH2:41][CH2:42]1.[CH3:44][CH2:45][OH:46].[F-:21].[F:10][c:11]1[c:12]([B:18]([OH:19])[OH:20])[c:13]([F:17])[cH:14][cH:15][cH:16]1.[K+:22].[Na+:37].[O:49]=[C:50]([CH:51]=[CH:52][c:53]1[cH:54][cH:55][cH:56][cH:57][cH:58]1)[CH:59]=[CH:60][c:61]1[cH:62][cH:63][cH:64][cH:65][cH:66]1.[O:67]=[C:68]([CH:69]=[CH:70][c:71]1[cH:72][cH:73][cH:74][cH:75][cH:76]1)[CH:77]=[CH:78][c:79]1[cH:80][cH:81][cH:82][cH:83][cH:84]1.[O:85]=[C:86]([CH:87]=[CH:88][c:89]1[cH:90][cH:91][cH:92][cH:93][cH:94]1)[CH:95]=[CH:96][c:97]1[cH:98][cH:99][cH:100][cH:101][cH:102]1.[OH2:43].[Pd:47].[Pd:48]>>[c:2]1(-[c:12]2[c:11]([F:10])[cH:16][cH:15][cH:14][c:13]2[F:17])[n:3][c:4]([CH3:9])[cH:5][cH:6][c:7]1[F:8]