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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 408714Generated: October 30, 2026

Dimethylformamide → HCID 66937462, compound

https://huagongshe.com/reaction/408714

Reaction equation

Participants

RoleNameHCIDCharge
ReactantDimethylformamideHCID 6228—
ReactantBenzyl mercaptanHCID 7509—
ReactantPotassium CarbonateHCID 11430—
Reactant4,5-Dichloro-2-nitroanilineHCID 81149—
SolventEthyl AcetateHCID 8857—
ProductHCID 66937462HCID 6693746256%

Reaction Conditions

Temperature70 °C

Reaction Steps

To a mixture of 4,5-dichloro-2-nitro-phenylamine (3.00 g, 14.5 mmol) and DMF (72 mL) was added K2CO3 (5.31 g, 29.0 mmol) and phenyl-methanethiol (3.94 g, 31.7 mmol). The mixture was heated to 70° C. for 18 h and then cooled to 23° C. The reaction mixture was dissolved in EtOAc (200 mL), washed with saturated sodium bicarbonate solution (100 mL), washed with brine (3×100 mL). The organic layers were combined, dried, filtered, and concentrated under reduced pressure. The residue was purified (FCC) (5-45% EtOAc/hexanes) to yield the titled compound (2.39 g, 56%). MS (ESI/CI): mass calcd. for C13H11ClN2O2S, 294.0; m/z found, 295.0 [M+H]+. 1H NMR (600 MHz, DMSO-d6): 7.96 (s, 1H), 7.56 (s, 2H), 7.50 (d, J=7.2 Hz, 2H), 7.37 (t, J=7.5 Hz, 2H), 7.31 (t, J=7.4 Hz, 1H), 7.05 (s, 1H), 4.27 (s, 2H).

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS08759345B2
Source datasetuspto-grants-2014_06
ORD IDord-d8d5fd2e91534b8aa1d99d1834b57643
Source noteuspto-grants-2014_06