HRID823301

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID176

Acetic Acid

C2H4O2

HCID962

Water

H2O

HCID1140

Toluene

C7H8

HCID148683

5-Quinolinamine, 2-methyl-

C10H10N2

结构：CC(C)(CC(O)(C=O)C(F)(F)F)c1cc(F)cc2c1OCC2

HCID44184989

5-Fluoro-2,3-dihydro-α-hydroxy-γ,γ-dimethyl-α-(trifluoromethyl)-7-benzofuranbutanal

C15H16F4O3

PRODUCTS

生成物

结构：Cc1ccc2c(N=CC(O)(CC(C)(C)c3cc(F)cc4c3OCC4)C(F)(F)F)cccc2n1

HCID44185044

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-7fbb749feecd4161a0962934862d42f5
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

[CH3:36][C:37](=[O:38])[OH:39].[CH3:40][c:41]1[cH:42][cH:43][cH:44][cH:45][cH:46]1.[F:1][c:2]1[cH:3][c:4]([C:11]([CH2:12][C:13]([CH:14]=[O:15])([C:16]([F:17])([F:18])[F:19])[OH:20])([CH3:21])[CH3:22])[c:5]2[c:6]([cH:10]1)[CH2:7][CH2:8][O:9]2.[NH2:23][c:24]1[c:25]2[cH:26][cH:27][c:28]([CH3:34])[n:29][c:30]2[cH:31][cH:32][cH:33]1.[OH2:35]>>[F:1][c:2]1[cH:3][c:4]([C:11]([CH2:12][C:13]([CH:14]=[N:23][c:24]2[c:25]3[cH:26][cH:27][c:28]([CH3:34])[n:29][c:30]3[cH:31][cH:32][cH:33]2)([C:16]([F:17])([F:18])[F:19])[OH:20])([CH3:21])[CH3:22])[c:5]2[c:6]([cH:10]1)[CH2:7][CH2:8][O:9]2