HRID1134939

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID312

Chloride

Cl-

2 次

HCID313

Hydrochloric Acid

ClH

HCID962

Water

H2O

HCID8028

Tetrahydrofuran

C4H8O

HCID11776

Triphenylphosphine

C18H15P

4 次

HCID12732

1-Hexyne

C6H10

HCID23938

Palladium

HCID32051

Zinc (II) cation

Zn+2

HCID14025500

未命名化合物

HCID178418339

Butyllithium

C4H9Li

PRODUCTS

生成物

HCID313

Hydrochloric Acid

ClH

HCID14128158

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-cf7321097d9f4114b919e7bf189f90a4
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

[CH3:7][CH2:8][CH2:9][CH2:10][Li:11].[CH:1]#[C:2][CH2:3][CH2:4][CH2:5][CH3:6].[Cl-:32].[Cl-:34].[ClH:26].[I:12][c:13]1[c:14]([CH2:21][CH2:22][N:23]([CH3:24])[CH3:25])[cH:15][c:16]([O:19][CH3:20])[cH:17][cH:18]1.[O:27]1[CH2:28][CH2:29][CH2:30][CH2:31]1.[OH2:112].[Pd:35].[Zn+2:33].[c:36]1([P:37]([c:38]2[cH:39][cH:40][cH:41][cH:42][cH:43]2)[c:44]2[cH:45][cH:46][cH:47][cH:48][cH:49]2)[cH:50][cH:51][cH:52][cH:53][cH:54]1.[c:55]1([P:56]([c:57]2[cH:58][cH:59][cH:60][cH:61][cH:62]2)[c:63]2[cH:64][cH:65][cH:66][cH:67][cH:68]2)[cH:69][cH:70][cH:71][cH:72][cH:73]1.[c:74]1([P:75]([c:76]2[cH:77][cH:78][cH:79][cH:80][cH:81]2)[c:82]2[cH:83][cH:84][cH:85][cH:86][cH:87]2)[cH:88][cH:89][cH:90][cH:91][cH:92]1.[c:93]1([P:94]([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)[cH:107][cH:108][cH:109][cH:110][cH:111]1>>[C:1](#[C:2][CH2:3][CH2:4][CH2:5][CH3:6])[c:13]1[c:14]([CH2:21][CH2:22][N:23]([CH3:24])[CH3:25])[cH:15][c:16]([O:19][CH3:20])[cH:17][cH:18]1.[ClH:26]