HRID808421

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID962

Water

H2O

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID6342

Acetonitrile

C2H3N

HCID6344

Dichloromethane

CH2Cl2

HCID6386

tert-Butyl alcohol

C4H10O

HCID8028

Tetrahydrofuran

C4H8O

HCID8471

Triethylamine

C6H15N

HCID14232

N-Methoxymethylamine

C2H7NO

HCID65578

Ethanedioyl dichloride

C2Cl2O2

HCID22575053

未命名化合物

结构：COc1ccc(-c2ccc(C(F)(F)C(=O)N(C)OC)cc2)cc1

HCID22575057

未命名化合物

PRODUCTS

生成物

结构：COc1ccc(-c2ccc(C(F)(F)CCC(=O)O)cc2)cc1

HCID9839508

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-b693a7c5844341a5b37819998d8ee6fb
来源数据集: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Test data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[C:73]([OH:74])([CH3:75])([CH3:76])[CH3:77].[CH2:78]1[O:79][CH2:80][CH2:81][CH2:82]1.[CH3:50][N:51]([CH3:52])[CH:53]=[O:54].[CH3:56][NH:57][O:58][CH3:59].[CH3:60][CH2:61][N:62]([CH2:63][CH3:64])[CH2:65][CH3:66].[CH3:70][C:71]#[N:72].[Cl:44][C:45]([C:46]([Cl:47])=[O:48])=[O:49].[Cl:67][CH2:68][Cl:69].[ClH:55].[F:1][C:2]([C:3]([N:4]([O:5][CH3:6])[CH3:7])=[O:8])([c:9]1[cH:10][cH:11][c:12](-[c:15]2[cH:16][cH:17][c:18]([O:21][CH3:22])[cH:19][cH:20]2)[cH:13][cH:14]1)[F:23].[F:24][C:25]([C:26](=[O:27])[OH:28])([F:29])[c:30]1[cH:31][cH:32][c:33](-[c:34]2[cH:35][cH:36][c:37]([O:38][CH3:39])[cH:40][cH:41]2)[cH:42][cH:43]1.[OH2:83]>>[F:1][C:2]([CH2:3][CH2:25][C:26](=[O:27])[OH:28])([c:9]1[cH:10][cH:11][c:12](-[c:15]2[cH:16][cH:17][c:18]([O:21][CH3:22])[cH:19][cH:20]2)[cH:13][cH:14]1)[F:23]