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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 2083180Generated: October 26, 2026

Water → 4-Nitro-6-(trifluoromethyl)-2H-1,3-benzodithiol-2-one

https://huagongshe.com/reaction/2083180

Reaction equation

Participants

RoleNameHCIDCharge
ReactantWaterHCID 962—
ReactantChloroformHCID 6212—
Reactant4-Chloro-3,5-dinitrobenzotrifluorideHCID 9809—
ReactantSodium dimethyldithiocarbamic acidHCID 24189202—
SolventDimethyl SulfoxideHCID 679—
Product4-Nitro-6-(trifluoromethyl)-2H-1,3-benzodithiol-2-oneHCID 1236111043.3%

Reaction Steps

The compound of Example I is prepared in the following manner: To a magnetically stirred solution of 16.2 g (60 mmoles) 2,6-dinitro-4-trifluoromethylchlorobenzene in 60 ml dimethylsulfoxide was added dropwise a solution of 10.74 g (60 mmoles) sodium dimethyldithiocarbamic acid. The reaction is mildly exothermic and accompanied by evolution of oxides of nitrogen. After allowing the reaction mixture to stir for 3 hours, 450 ml water and 225 ml chloroform are added and, after shaking well in an extraction funnel, the chloroform extract was withdrawn and the aqueous phase similarly extracted with two more 220 ml portions of chloroform. The combined chloroform extract was washed thrice with 750 ml portions of water, and dried over anhy. Na2SO4. After removing the solvent on a rotary evaporator, the residue was chromatographed over 180 g Silica-Gel. Elution with hexane-benzene (1:1) yielded 7.3 g (43.3%) 4-nitro-6-trifluoromethyl-1,3-benzodithiole-2-one, m.p. 103°-107° C. One recrystallization from ethanol yielded product, m.p. 111°-112° C.

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS04084954
Source datasetuspto-grants-1978_04
ORD IDord-ccdb8a935dde4c9a880bfde081cd6aa2
Source noteuspto-grants-1978_04