Dimethylformamide → 2-Chloro-5-benzoxazolecarbonitrile

Reaction equation

[Cl:22][CH2:23][Cl:24].[O:17]=[CH:18][N:19]([CH3:20])[CH3:21].[S:13]([Cl:14])([Cl:15])=[O:16].[S:1]=[c:2]1[o:3][c:4]2[c:5]([nH:6]1)[cH:7][c:8]([C:11]#[N:12])[cH:9][cH:10]2>>[c:2]1([Cl:15])[o:3][c:4]2[c:5]([n:6]1)[cH:7][c:8]([C:11]#[N:12])[cH:9][cH:10]2

Participants

Reactant 4

HCID 6228Dimethylformamide

HCID 6344Dichloromethane

HCID 24386Thionyl Chloride

HCID 105114792-Thioxo-2,3-dihydro-1,3-benzoxazole-5-carbonitrile

Product 1

HCID 106311802-Chloro-5-benzoxazolecarbonitrile

Sources & evidence

ORD record: ord-8355273e03bd4f868e79717d185a7d76
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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