HRID824874

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID702

Ethanol

C2H6O

HCID923

Sodium ion

Na+

2 次

HCID1140

Toluene

C7H8

HCID19660

Carbonate

CO3-2

HCID66827

Boronic acid, phenyl-

C6H7BO2

结构：O=C(c1ccccc1)c1cnc2c(C(F)(F)F)cccc2c1Cl

HCID16090325

未命名化合物

结构：c1ccc([PH](c2ccccc2)(c2ccccc2)[Pd]([PH](c2ccccc2)(c2ccccc2)c2ccccc2)([PH](c2ccccc2)(c2ccccc2)c2ccccc2)[PH](c2ccccc2)(c2ccccc2)c2ccccc2)cc1

HCID178420554

未命名化合物

PRODUCTS

生成物

结构：O=C(c1ccccc1)c1cnc2c(C(F)(F)F)cccc2c1-c1ccccc1

HCID11360909

Phenyl[4-phenyl-8-(trifluoromethyl)quinolin-3-yl]methanone

C23H14F3NO

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-ac3b0de005fd40b4bf156e5dd0dba5d4
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

[C:33](=[O:34])([O-:35])[O-:36].[CH3:116][c:117]1[cH:118][cH:119][cH:120][cH:121][cH:122]1.[CH3:123][CH2:124][OH:125].[Cl:1][c:2]1[c:3]([C:16](=[O:17])[c:18]2[cH:19][cH:20][cH:21][cH:22][cH:23]2)[cH:4][n:5][c:6]2[c:7]([C:12]([F:13])([F:14])[F:15])[cH:8][cH:9][cH:10][c:11]12.[Na+:37].[Na+:38].[OH:24][B:25]([OH:26])[c:27]1[cH:28][cH:29][cH:30][cH:31][cH:32]1.[cH:39]1[cH:40][cH:41][c:42]([P:43]([Pd:44]([P:45]([c:46]2[cH:47][cH:48][cH:49][cH:50][cH:51]2)([c:52]2[cH:53][cH:54][cH:55][cH:56][cH:57]2)[c:58]2[cH:59][cH:60][cH:61][cH:62][cH:63]2)([P:64]([c:65]2[cH:66][cH:67][cH:68][cH:69][cH:70]2)([c:71]2[cH:72][cH:73][cH:74][cH:75][cH:76]2)[c:77]2[cH:78][cH:79][cH:80][cH:81][cH:82]2)[P:83]([c:84]2[cH:85][cH:86][cH:87][cH:88][cH:89]2)([c:90]2[cH:91][cH:92][cH:93][cH:94][cH:95]2)[c:96]2[cH:97][cH:98][cH:99][cH:100][cH:101]2)([c:102]2[cH:103][cH:104][cH:105][cH:106][cH:107]2)[c:108]2[cH:109][cH:110][cH:111][cH:112][cH:113]2)[cH:114][cH:115]1>>[c:2]1(-[c:27]2[cH:28][cH:29][cH:30][cH:31][cH:32]2)[c:3]([C:16](=[O:17])[c:18]2[cH:19][cH:20][cH:21][cH:22][cH:23]2)[cH:4][n:5][c:6]2[c:7]([C:12]([F:13])([F:14])[F:15])[cH:8][cH:9][cH:10][c:11]12