HRID698570

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

3 次

HCID1061

Phosphate

O4P-3

HCID4610

1,2-Cyclohexanediamine

C6H14N2

HCID6344

Dichloromethane

CH2Cl2

HCID8182

Dodecane

C12H26

HCID30165

Iodide ion

I-

HCID31275

1,4-Dioxane

C4H8O2

HCID140102

Benzenamine, 3-bromo-N,N-dimethyl-

C8H10BrN

HCID21110084

Methyl 1H-pyrrolo[2,3-b]pyridine-3-carboxylate

C9H8N2O2

PRODUCTS

生成物

结构：COC(=O)c1cn(-c2cccc(N(C)C)c2)c2ncccc12

HCID21110081

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-f567b63286d34e0d9990f78fc4ca7124
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应 SMILES

[Br:10][c:11]1[cH:12][c:13]([N:14]([CH3:15])[CH3:16])[cH:17][cH:18][cH:19]1.[CH3:41][CH2:42][CH2:43][CH2:44][CH2:45][CH2:46][CH2:47][CH2:48][CH2:49][CH2:50][CH2:51][CH3:52].[CH:20]1([NH2:21])[CH2:22][CH2:23][CH2:24][CH2:25][CH:26]1[NH2:27].[Cl:59][CH2:60][Cl:61].[I-:1].[K+:7].[K+:8].[K+:9].[O:53]1[CH2:54][CH2:55][O:56][CH2:57][CH2:58]1.[P:2]([O-:3])([O-:4])([O-:5])=[O:6].[nH:28]1[cH:29][c:30]([C:37](=[O:38])[O:39][CH3:40])[c:31]2[c:32]1[n:33][cH:34][cH:35][cH:36]2>>[c:11]1(-[n:28]2[cH:29][c:30]([C:37](=[O:38])[O:39][CH3:40])[c:31]3[c:32]2[n:33][cH:34][cH:35][cH:36]3)[cH:12][c:13]([N:14]([CH3:15])[CH3:16])[cH:17][cH:18][cH:19]1