Ethyl Acetate → 4-Chloro-3-iodobenzamide

Reaction equation

[CH2:16]1[O:17][CH2:18][CH2:19][O:20][CH2:21]1.[CH3:31][CH2:32][O:33][C:34](=[O:35])[CH3:36].[CH:22]([N:25]([CH:23]([CH3:24])[CH3:26])[CH2:27][CH3:28])([CH3:29])[CH3:30].[Cl:1][c:2]1[c:3]([I:11])[cH:4][c:5]([C:6](=[O:7])[OH:8])[cH:9][cH:10]1.[S:12]([Cl:13])([Cl:14])=[O:15]>>[Cl:1][c:2]1[c:3]([I:11])[cH:4][c:5]([C:6](=[O:7])[NH2:25])[cH:9][cH:10]1

Participants

Reactant 5

HCID 8857Ethyl Acetate

HCID 24386Thionyl Chloride

HCID 312751,4-Dioxane

HCID 81531Diisopropylethylamine

HCID 27576164-Chloro-3-iodobenzoic acid

Product 1

HCID 221155764-Chloro-3-iodobenzamide

Sources & evidence

ORD record: ord-f7394d1444f1468ca14c30a10f12d7e7
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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