HRID195676

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID6342

Acetonitrile

C2H3N

HCID9886

Hexafluorophosphate ion

F6P-

HCID81531

Diisopropylethylamine

C8H19N

HCID2733180

未命名化合物

HCID11528441

2-(1,3-Dimethylbutyl)aniline

C12H19N

HCID23094022

2-Iodothiophene-3-carboxylic acid

C5H3IO2S

PRODUCTS

产物

HCID11315926

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-da3ad0764b9948619c9998b21d529b5b
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:17][P+:18]([N:19]1[CH2:20][CH2:21][CH2:22][CH2:23]1)([N:24]1[CH2:25][CH2:26][CH2:27][CH2:28]1)[N:29]1[CH2:30][CH2:31][CH2:32][CH2:33]1.[CH3:43][CH:44]([CH2:45][CH:46]([CH3:47])[CH3:48])[c:49]1[c:50]([NH2:55])[cH:51][cH:52][cH:53][cH:54]1.[CH3:56][C:57]#[N:58].[CH:1]([N:2]([CH2:3][CH3:4])[CH:5]([CH3:6])[CH3:7])([CH3:8])[CH3:9].[I:34][c:35]1[s:36][cH:37][cH:38][c:39]1[C:40](=[O:41])[OH:42].[OH2:59].[P-:10]([F:11])([F:12])([F:13])([F:14])([F:15])[F:16]>>[I:34][c:35]1[s:36][cH:37][cH:38][c:39]1[C:40](=[O:42])[NH:55][c:50]1[c:49]([CH:44]([CH3:43])[CH2:45][CH:46]([CH3:47])[CH3:48])[cH:54][cH:53][cH:52][cH:51]1