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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 2256937Generated: November 1, 2026

Carbon Dioxide → Benzoic acid, 2-(methylthio)-4-(trifluoromethyl)-

https://huagongshe.com/reaction/2256937

Reaction equation

Participants

RoleNameHCIDCharge
ReactantCarbon DioxideHCID 280—
ReactantHydrochloric AcidHCID 313—
ReactantBenzene, 1-bromo-2-(methylthio)-4-(trifluoromethyl)-HCID 11000144—
ReactantButyllithiumHCID 178418339—
SolventDiethyl EtherHCID 3283—
ProductBenzoic acid, 2-(methylthio)-4-(trifluoromethyl)-HCID 11085762—

Reaction Conditions

Temperature-70 °C

Reaction Steps

n-Butyllithium (2.5M solution in hexane; 25 ml) was added under an inert atmosphere to a stirred solution 4-bromo-3-methylsulphenylbenzotrifluoride (16.4 g) in ether whilst maintaining the temperature below -70° C. The mixture was stirred at -70° C. for 2 hours and then poured onto solid carbon dioxide pellets. The mixture was stirred for 10 minutes and aqueous hydrochloric acid was added. The layers were separated and the aqueous layer was extracted with ether. The combined organic layers were washed with water, dried (anhydrous magnesium sulphate) and filtered. The filtrate was evaporated and the residue was triturated with cyclohexane and filtered to give 2-methylsulphenyl-4-trifluoromethylbenzoic acid (12.4 g) as a white solid, NMR [CDCl3 +DMSO-d6 ]: 2.45 (s,3H), 7.2(d, 1H), 7.3(s, 1H), 8.0 (d, 1H), 10.7-11.1 (bs, 1H).

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS05656573
Source datasetuspto-grants-1997_08
ORD IDord-2c604e27c3994b4382b5aa79411077a3
Source noteuspto-grants-1997_08