Sodium ion → 6-Chloro-4-isopropoxy-2-methyl-nicotinic acid isopropyl ester

HRID 1551947Notes

Reaction equation

[CH2:22]1[O:23][CH2:24][CH2:25][CH2:26]1.[CH:1]([CH3:2])([CH3:3])[OH:4].[CH:7]([CH3:8])([CH3:9])[O:10][C:11]([c:12]1[c:13]([CH3:20])[n:14][c:15]([Cl:19])[cH:16][c:17]1[Cl:18])=[O:21].[Cu:27][I:28].[H-:6].[Na+:5]>>[CH:1]([CH3:2])([CH3:3])[O:4][c:17]1[c:12]([C:11]([O:10][CH:7]([CH3:8])[CH3:9])=[O:21])[c:13]([CH3:20])[n:14][c:15]([Cl:19])[cH:16]1

Participants

Reactant 6

HCID 923Sodium ion

HCID 3776Isopropanol

HCID 8028Tetrahydrofuran

HCID 24350Copper(1+) iodide; Copper(I) iodide; Cuprous iodide; Cuprous iodide (CuI)

HCID 166653Hydride

HCID 86593990Isopropyl 4,6-dichloro-2-methylnicotinate

Product 1

HCID 865939896-Chloro-4-isopropoxy-2-methyl-nicotinic acid isopropyl ester

Sources & evidence

ORD record: ord-16dee775352845edaa0fc711320e8b4a
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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