HRID805261

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID222

Ammonia gas

H3N

HCID313

Hydrochloric Acid

ClH

HCID887

Methanol

CH4O

HCID7237

o-Xylene

C8H10

HCID8028

Tetrahydrofuran

C4H8O

HCID28486

Lithium ion

Li+

HCID104727

Aluminum Cation

Al+3

HCID166653

Hydride

H-

4 次

HCID602731

methyl 2-(4-hydroxyphenoxy)acetate

C9H10O4

HCID20555068

未命名化合物

PRODUCTS

产物

HCID313

Hydrochloric Acid

ClH

反应SMILES：O=C1N=c2cccc(OCC(O)CNCCOc3ccc(O)cc3)c2=N1

HCID20497028

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-b0fad3ff936c40e3b8867c1583855187
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

[Al+3:31].[CH3:17][O:18][C:19]([CH2:20][O:21][c:22]1[cH:23][cH:24][c:25]([OH:28])[cH:26][cH:27]1)=[O:29].[CH3:51][OH:52].[ClH:36].[H-:30].[H-:33].[H-:34].[H-:35].[Li+:32].[NH2:1][CH2:2][CH:3]([CH2:4][O:5][c:6]1[cH:7][cH:8][cH:9][c:10]2[c:14]1=[N:13][C:12](=[O:15])[N:11]=2)[OH:16].[NH3:37].[O:46]1[CH2:47][CH2:48][CH2:49][CH2:50]1.[c:38]1([CH3:39])[c:40]([CH3:41])[cH:42][cH:43][cH:44][cH:45]1>>[ClH:36].[NH:1]([CH2:2][CH:3]([CH2:4][O:5][c:6]1[cH:7][cH:8][cH:9][c:10]2[c:14]1=[N:13][C:12](=[O:15])[N:11]=2)[OH:16])[CH2:19][CH2:20][O:21][c:22]1[cH:23][cH:24][c:25]([OH:28])[cH:26][cH:27]1