HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1727038Generated: October 26, 2026
Methyl 4-(chlorocarbonyl)benzoate → Methyl 4-isothiocyanatocarbonylbenzoate
https://huagongshe.com/reaction/1727038
Participants
| Role | Name | HCID | Charge |
|---|
| Reactant | Methyl 4-(chlorocarbonyl)benzoate | HCID 81850 | — |
| Reactant | Potassium thiocyanate | HCID 516872 | — |
| Solvent | Acetonitrile | HCID 6342 | — |
| Product | Methyl 4-isothiocyanatocarbonylbenzoate | HCID 59695236 | 95% |
Reaction Steps
Potassium thiocyanate (1.08 g, 1.1 eq) is added to a solution of methyl-4-chlorocarbonylbenzoate (2 g) in acetonitrile (30 ml). After stirring for 1 hour at approximately 20° C., the mixture is filtered and the filtrate is concentrated under reduced pressure at 40° C. The solid obtained is purified by flash chromatography on silica gel (eluent: heptane/ethyl acetate 1:1) in order to produce the expected compound (2.1 g; 95% yield).
Provenance & Evidence
| DOI | 10.6084/m9.figshare.5104873.v1 |
|---|
| Patent number | US07495009B2 |
|---|
| Source dataset | uspto-grants-2009_02 |
|---|
| ORD ID | ord-eb95d2aa433949d8b2323c914d21fa34 |
|---|
| Source note | uspto-grants-2009_02 |
|---|