HRID316223

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID175

Acetate

C2H3O2-

2 次

HCID962

Water

H2O

HCID1140

Toluene

C7H8

HCID5943

Carbon tetrachloride

CCl4

HCID7937

2,6-Dimethylpyridine

C7H9N

HCID9845

Trifluoroacetic anhydride

C4F6O3

HCID26255

Tetrafluoroborate

BF4-

HCID105144

Palladium(2+)

Pd+2

HCID3571326

未命名化合物

HCID5148195

tert-Butyl 2,5-dihydro-1H-pyrrole-1-carboxylate

C9H15NO2

PRODUCTS

生成物

HCID59001787

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-9af94470171a4d8fa56447c3734aa433
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

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