Acetone → HCID 21876400, compound

HRID 208480Notes

Reaction equation

HRID 208480 reaction equation
[C:22]([CH2:23][C:24](=[O:25])[O:26][CH2:27][CH3:28])(=[O:29])[O:30][CH2:31][CH3:32].[CH3:35][C:36](=[O:37])[CH3:38].[Cl:1][c:2]1[c:3]([N+:19](=[O:20])[O-:21])[c:4]([NH:9][c:10]2[cH:11][cH:12][c:13]([CH2:16][CH2:17][OH:18])[cH:14][cH:15]2)[n:5][c:6]([CH3:8])[n:7]1.[Na+:34].[OH-:33]>>[c:2]1([CH:23]([C:22](=[O:29])[O:30][CH2:31][CH3:32])[C:24](=[O:25])[O:26][CH2:27][CH3:28])[c:3]([N+:19](=[O:20])[O-:21])[c:4]([NH:9][c:10]2[cH:11][cH:12][c:13]([CH2:16][CH2:17][OH:18])[cH:14][cH:15]2)[n:5][c:6]([CH3:8])[n:7]1

Participants

6

Reactant 5

HCID 180AcetoneHCID 923Sodium ionHCID 961HydroxideHCID 7761Diethyl MalonateHCID 21876505HCID 21876505, compound

Product 1

HCID 21876400HCID 21876400, compound

Sources & evidence

ORD record
ord-e09e4d59006a47c891874a29c1b363da
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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