HRID116930

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID702

Ethanol

C2H6O

HCID8028

Tetrahydrofuran

C4H8O

HCID8058

n-Hexane

C6H14

HCID8068

1-Butanamine, N-methyl-

C5H13N

HCID8471

Triethylamine

C6H15N

HCID28123

Tetrahydroborate

H4B-

HCID28486

Lithium ion

Li+

HCID31297

Methanesulfonyl chloride

CH3ClO2S

HCID167693

未命名化合物

HCID21085836

3-(Methoxycarbonyl)-5-(1,3-oxazol-2-yl)benzoic acid

C12H9NO5

PRODUCTS

生成物

HCID21086166

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-90fefb4400f44c72a2806f393390d6e0
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

[BH4-:19].[CH3:1][O:2][C:3](=[O:4])[c:5]1[cH:6][c:7]([C:8]([OH:9])=[O:10])[cH:11][c:12](-[c:14]2[o:15][cH:16][cH:17][n:18]2)[cH:13]1.[CH3:22][Si:23]([CH:24]=[N+:25]=[N-:26])([CH3:27])[CH3:28].[CH3:29][CH2:30][CH2:31][CH2:32][CH2:33][CH3:34].[CH3:35][S:36](=[O:37])(=[O:38])[Cl:39].[CH3:40][CH2:41][N:42]([CH2:43][CH3:44])[CH2:45][CH3:46].[CH3:47][CH2:48][CH2:49][CH2:50][NH:51][CH3:52].[CH3:58][CH2:59][OH:60].[ClH:21].[Li+:20].[O:53]1[CH2:54][CH2:55][CH2:56][CH2:57]1>>[CH3:1][O:2][C:3](=[O:4])[c:5]1[cH:6][c:7]([CH2:8][N:51]([CH2:50][CH2:49][CH2:48][CH3:47])[CH3:52])[cH:11][c:12](-[c:14]2[o:15][cH:16][cH:17][n:18]2)[cH:13]1