HRID183396

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID961

Hydroxide

HO-

HCID962

Water

H2O

HCID7842

Propargyl bromide

C3H3Br

HCID8028

Tetrahydrofuran

C4H8O

2 次

HCID78870

2-Bromo-4-nitroanisole

C7H6BrNO3

HCID78966

9-Borabicyclo[3.3.1]nonane

C8H15B

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

HCID58858103

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-c97ff3744c714048bfc26a64fa519c1a
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

[Br:21][c:22]1[c:23]([O:31][CH3:32])[cH:24][cH:25][c:26]([N+:28](=[O:29])[O-:30])[cH:27]1.[CH2:10]1[O:11][CH2:12][CH2:13][CH2:14]1.[CH2:15]([Br:16])[C:17]#[CH:18].[CH2:34]1[O:35][CH2:36][CH2:37][CH2:38]1.[CH:1]12[BH:4][CH:3]([CH2:2][CH2:8][CH2:9]1)[CH2:5][CH2:6][CH2:7]2.[Na+:20].[OH-:19].[OH2:33].[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>>[CH2:1]1[CH:8]([c:22]2[c:23]([O:31][CH3:32])[cH:24][cH:25][c:26]([N+:28](=[O:29])[O-:30])[cH:27]2)[CH2:9]1