HRID1118751

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8071

未命名化合物

HCID11776

Triphenylphosphine

C18H15P

4 次

HCID23938

Palladium

HCID28179

Fluoride

F-

HCID79799

p-Tolueneboronic acid

C7H9BO2

HCID104967

Cesium(1+)

Cs+

结构：CCOC(=O)C(CC1CC1)c1cc(Cl)c(OCC(F)(F)F)c(Br)c1

HCID57995641

未命名化合物

PRODUCTS

生成物

结构：CCOC(=O)C(CC1CC1)c1cc(Cl)c(OCC(F)(F)F)c(-c2ccc(C)cc2)c1

HCID57995605

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-79fb89655f9347cb905dbaf19e818858
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (7/10)

反应 SMILES

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