Acetic Acid → HCID 67107302, compound

HRID 1551006Notes

Reaction equation

HRID 1551006 reaction equation
[C:19]([CH2:20][C:21](=[O:22])[O:23][CH2:24][CH3:25])(=[O:26])[O:27][CH2:28][CH3:29].[CH2:30]1[O:31][CH2:32][CH2:33][CH2:34]1.[CH3:1][c:2]1[c:3]([C:4](=[O:5])[OH:6])[cH:7][cH:8][cH:9][n:10]1.[CH3:35][C:36](=[O:37])[OH:38].[Cl:13][C:14]([O:15][CH2:16][CH3:17])=[O:18].[H-:11].[Na+:12]>>[CH3:1][c:2]1[c:3]([C:4](=[O:6])[CH:20]([C:19](=[O:26])[O:27][CH2:28][CH3:29])[C:21](=[O:22])[O:23][CH2:24][CH3:25])[cH:7][cH:8][cH:9][n:10]1

Participants

8

Reactant 7

HCID 176Acetic AcidHCID 923Sodium ionHCID 7761Diethyl MalonateHCID 8028TetrahydrofuranHCID 10928Ethyl chloroformateHCID 166653HydrideHCID 6433732-Methylnicotinic acid

Product 1

HCID 67107302HCID 67107302, compound

Sources & evidence

ORD record
ord-00efc6526b8b4df985475ea0c83e24b3
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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