HRID956797

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID223

Ammonia ion (NH4+)

H4N+

HCID259

Bromide

Br-

HCID312

Chloride

Cl-

HCID8028

Tetrahydrofuran

C4H8O

HCID11776

Triphenylphosphine

C18H15P

HCID23938

Palladium

2 次

HCID95417

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

C17H14O

3 次

结构：O=C(OC1C(COC(c2ccccc2)(c2ccccc2)c2ccccc2)OC(n2cnc3c(Cl)ncnc32)C1F)c1ccccc1

HCID18516766

未命名化合物

HCID178528070

未命名化合物

PRODUCTS

生成物

结构：O=C(OC1C(COC(c2ccccc2)(c2ccccc2)c2ccccc2)OC(n2cnc3c(CCc4ccccc4)ncnc32)C1F)c1ccccc1

HCID67164881

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-f3887416b79a4bb58e47320e08020827
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

[Br-:66].[C:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)(=[O:8])[O:9][CH:10]1[CH:11]([CH2:26][O:27][C:28]([c:29]2[cH:30][cH:31][cH:32][cH:33][cH:34]2)([c:35]2[cH:36][cH:37][cH:38][cH:39][cH:40]2)[c:41]2[cH:42][cH:43][cH:44][cH:45][cH:46]2)[O:12][CH:13]([n:16]2[c:17]3[n:18][cH:19][n:20][c:21]([Cl:25])[c:22]3[n:23][cH:24]2)[CH:14]1[F:15].[CH2:67]([CH2:68][c:69]1[cH:70][cH:71][cH:72][cH:73][cH:74]1)[Zn+:75].[Cl-:76].[NH4+:77].[O:116]=[C:117]([CH:118]=[CH:119][c:120]1[cH:121][cH:122][cH:123][cH:124][cH:125]1)[CH:126]=[CH:127][c:128]1[cH:129][cH:130][cH:131][cH:132][cH:133]1.[O:134]1[CH2:135][CH2:136][CH2:137][CH2:138]1.[O:80]=[C:81]([CH:82]=[CH:83][c:84]1[cH:85][cH:86][cH:87][cH:88][cH:89]1)[CH:90]=[CH:91][c:92]1[cH:93][cH:94][cH:95][cH:96][cH:97]1.[O:98]=[C:99]([CH:100]=[CH:101][c:102]1[cH:103][cH:104][cH:105][cH:106][cH:107]1)[CH:108]=[CH:109][c:110]1[cH:111][cH:112][cH:113][cH:114][cH:115]1.[Pd:78].[Pd:79].[c:47]1([P:48]([c:49]2[cH:50][cH:51][cH:52][cH:53][cH:54]2)[c:55]2[cH:56][cH:57][cH:58][cH:59][cH:60]2)[cH:61][cH:62][cH:63][cH:64][cH:65]1>>[C:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)(=[O:8])[O:9][CH:10]1[CH:11]([CH2:26][O:27][C:28]([c:29]2[cH:30][cH:31][cH:32][cH:33][cH:34]2)([c:35]2[cH:36][cH:37][cH:38][cH:39][cH:40]2)[c:41]2[cH:42][cH:43][cH:44][cH:45][cH:46]2)[O:12][CH:13]([n:16]2[c:17]3[n:18][cH:19][n:20][c:21]([CH2:67][CH2:68][c:69]4[cH:70][cH:71][cH:72][cH:73][cH:74]4)[c:22]3[n:23][cH:24]2)[CH:14]1[F:15]