HRID107822

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

HCID7520

Benzene, (methylthio)-

C7H8S

HCID19660

Carbonate

CO3-2

HCID61668

Boronic acid

H3BO2

HCID85983244

未命名化合物

结构：c1ccc([PH](c2ccccc2)(c2ccccc2)[Pd-4]([PH](c2ccccc2)(c2ccccc2)c2ccccc2)([PH](c2ccccc2)(c2ccccc2)c2ccccc2)[PH](c2ccccc2)(c2ccccc2)c2ccccc2)cc1

HCID178420553

未命名化合物

PRODUCTS

生成物

HCID67084468

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-1d127b6481d1470c99eb319e5d9b54e1
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

[BH:14]([OH:15])[OH:16].[CH2:1]([CH3:2])[O:3][C:4]([C:5](=[CH:6][CH:7]1[CH2:8][CH2:9][CH2:10][CH2:11]1)[Br:12])=[O:13].[CH3:17][S:18][c:19]1[cH:20][cH:21][cH:22][cH:23][cH:24]1.[CH3:25][CH2:26][OH:27].[CH3:34][c:35]1[cH:36][cH:37][cH:38][cH:39][cH:40]1.[Na+:28].[Na+:29].[O-:30][C:31](=[O:32])[O-:33].[c:41]1([PH:42]([Pd-4:43]([PH: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)[c:57]2[cH:58][cH:59][cH:60][cH:61][cH:62]2)([PH: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)[c:76]2[cH:77][cH:78][cH:79][cH:80][cH:81]2)[PH: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)[c:95]2[cH:96][cH:97][cH:98][cH:99][cH:100]2)([c:101]2[cH:102][cH:103][cH:104][cH:105][cH:106]2)[c:107]2[cH:108][cH:109][cH:110][cH:111][cH:112]2)[cH:113][cH:114][cH:115][cH:116][cH:117]1>>[CH2:1]([CH3:2])[O:3][C:4]([C:5](=[CH:6][CH:7]1[CH2:8][CH2:9][CH2:10][CH2:11]1)[c:22]1[cH:21][cH:20][c:19]([S:18][CH3:17])[cH:24][cH:23]1)=[O:13]