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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 2419126Generated: November 3, 2026

Phenyl Isothiocyanate → HCID 20313835, compound

https://huagongshe.com/reaction/2419126

Reaction equation

Participants

RoleNameHCIDCharge
ReactantPhenyl IsothiocyanateHCID 7673—
Reactant5-Nitro-1,2,3-benzothiadiazoleHCID 12494996—
ProductHCID 20313835HCID 20313835—

Reaction Steps

A solution of 5-nitro-1,2,3-benzothiadiazole (4.6 g) in 50 ml of phenylisothiocyanate is heated at 220° C under an inert atmosphere until the evolution of nitrogen ceases (approximately 3 hours). The excess phenylisothiocyanate is removed in vacuo and the resultant residue chromatographed on 1000 ml of silica gel eluting with methylene chloride/pentane (1:4). The fractions containing the desired product are combined and concentrated in vacuo. The resultant solid is recrystallized from cyclohexane to yield 2.1 g of the title compound, melting point 136°-138° C.

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS04104467
Source datasetuspto-grants-1978_08
ORD IDord-c19704cde94b404e89daf7a2114a0667
Source noteuspto-grants-1978_08