HRID2130335

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

2 次

HCID962

Water

H2O

HCID8028

Tetrahydrofuran

C4H8O

HCID8857

Ethyl acetate

C4H8O2

HCID9222

1H-Pyrrolo[2,3-b]pyridine

C7H6N2

HCID19660

Carbonate

CO3-2

HCID2734702

3,4-Dimethoxyphenylboronic acid

C8H11BO4

HCID11389493

4-CHLORO-7-AZAINDOLE

C7H5ClN2

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

HCID11999024

4-(3,4-Dimethoxy-phenyl)-1H-pyrrolo[2,3-b]pyridine

C15H14N2O2

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-c9b6144c0b17473691816c7ceb0c971f
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (4/10)

反应 SMILES

[C:39](=[O:40])([O-:41])[O-:42].[CH3:20][O:21][c:22]1[cH:23][c:24]([B:30]([OH:31])[OH:32])[cH:25][cH:26][c:27]1[O:28][CH3:29].[CH3:33][CH2:34][O:35][C:36](=[O:37])[CH3:38].[Cl:1][c:2]1[c:3]2[cH:4][cH:5][nH:6][c:7]2[n:8][cH:9][cH:10]1.[K+:43].[K+:44].[O:46]1[CH2:47][CH2:48][CH2:49][CH2:50]1.[OH2:45].[cH:51]1[cH:52][cH:53][c:54]([P:55]([Pd:56]([P:57]([c:58]2[cH:59][cH:60][cH:61][cH:62][cH:63]2)([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)([P:76]([c:77]2[cH:78][cH:79][cH:80][cH:81][cH:82]2)([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)[P:95]([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)([c:114]2[cH:115][cH:116][cH:117][cH:118][cH:119]2)[c:120]2[cH:121][cH:122][cH:123][cH:124][cH:125]2)[cH:126][cH:127]1.[nH:11]1[c:12]2[c:13]([cH:14][cH:15][cH:16][n:17]2)[cH:18][cH:19]1>>[c:2]1(-[c:24]2[cH:23][c:22]([O:21][CH3:20])[c:27]([O:28][CH3:29])[cH:26][cH:25]2)[c:3]2[cH:4][cH:5][nH:6][c:7]2[n:8][cH:9][cH:10]1