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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1946625Generated: October 27, 2026

2-Mercaptobenzoic Acid → Methyl 2-(2-nitrophenylthio)benzoate

https://huagongshe.com/reaction/1946625

Reaction equation

Participants

RoleNameHCIDCharge
Reactant2-Mercaptobenzoic AcidHCID 5443—
ReactantMethyl iodideHCID 6328—
ReactantSodium hydrideHCID 24758—
Reactant1-Fluoro-2-nitrobenzeneHCID 73895—
SolventDimethylacetamideHCID 31374—
ProductMethyl 2-(2-nitrophenylthio)benzoateHCID 5736269376%

Reaction Conditions

Temperature80 °C

Reaction Steps

A solution of 2-mercaptobenzoic acid (6.0 g, 39.0 mmol) in dimethylacetamide (20 mL) was added to a suspension of sodium hydride (60% in oil, 3.1 g, 77.5 mmol) in dimethylacetamide (15 mL). The mixture was stirred for 5 minutes and 1-fluoro-2-nitrobenzene (5.0 g, 35.5 mmol) was added. The reaction mixture was heated at 80° C. for one hour. The mixture was cooled down to room temperature and methyl iodide (7.3 mL, 117.15 mmol) was added. The reaction mixture was stirred at room temperature 16 hours. The mixture was then poor into water and extracted with a mixture of 75% ethyl acetate in hexanes (3 times). The combined organic layers were washed with water and brine, dried over sodium sulfate, filtered and evaporated. The residue was dissolved in a minimum amount of dichloromethane and hexanes was added to precipitate the product. The solid was filtered and dried to afford title compound 408 (7.81 g, 76%) as a yellow solid. MS (m/z): 312.2 (M+H).

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS08399452B2
Source datasetuspto-grants-2013_03
ORD IDord-9456936d51834864bee9ae93d982d519
Source noteuspto-grants-2013_03