Acetic Acid → furo(3,4-b)pyridin-5(7H)-one

HRID 1137687Notes

Reaction equation

HRID 1137687 reaction equation
[CH2:12]([n:13]1[c:14]2[c:15]([cH:16][cH:17][cH:18][cH:19]2)[cH:20][c:21]1[CH3:22])[CH3:23].[CH2:24]([N:25]([c:26]1[cH:27][c:28]([O:29][CH2:30][CH3:31])[cH:32][cH:33][cH:34]1)[CH2:35][CH3:36])[CH3:37].[CH3:38][C:39]([O:40][C:41](=[O:42])[CH3:43])=[O:44].[CH3:54][C:55](=[O:56])[OH:57].[CH:49]([OH:50])([CH3:51])[CH3:52].[Cl-:46].[Cl-:48].[NH3:45].[OH2:53].[Zn+2:47].[n:1]1[c:2]2[c:7]([cH:8][cH:9][cH:10]1)[C:6](=[O:11])[O:5][C:3]2=[O:4]>>[n:1]1[c:2]2[c:7]([cH:8][cH:9][cH:10]1)[C:6](=[O:11])[O:5][CH2:3]2

Participants

11

Reactant 10

HCID 176Acetic AcidHCID 222AmmoniaHCID 312Chloride2×HCID 962WaterHCID 3776IsopropanolHCID 7918Acetic AnhydrideHCID 32051Zinc(2+)HCID 69688Furo[3,4-b]pyridine-5,7-dioneHCID 74625N,N-Diethyl-m-phenetidineHCID 1704321H-Indole, 1-ethyl-2-methyl-

Product 1

HCID 819439furo(3,4-b)pyridin-5(7H)-one

Sources & evidence

ORD record
ord-b35777c450b74f5295ae311545099dbb
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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