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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1068928Generated: October 31, 2026

Benzyl isocyanate → HCID 178522837, compound

https://huagongshe.com/reaction/1068928

Reaction equation

Participants

RoleNameHCIDCharge
ReactantBenzyl isocyanateHCID 76639—
ReactantHCID 178509242HCID 178509242—
Solvent1,3-Dimethyl-2-imidazolidinoneHCID 6661—
Solvent1,4-DioxaneHCID 31275—
ProductHCID 178522837HCID 178522837—

Reaction Steps

With the exclusion of moisture, 261 mg (1.00 mmol) of 3-amino-4-(3-chloro-phenylamino)-1H-pyrazolo[3,4-d]pyrimidine (see Step 1.6) are dissolved in 2.5 ml of dioxane and 1 ml of DMEU; 138 μl (1.1 mmol) of benzyl isocyanate are added and the reaction mixture is stirred at RT overnight. The dioxane is evaporated off from the reaction mixture in a rotary evaporator. The resulting yellow solution is poured into 75 ml of water and the product that precipitates is filtered off. Stirring in boiling ethyl acetate yields 3-(benzylamino-carbonylamino)-4-(3-chloro-phenylamino)-1H-pyrazolo[3,4-d]pyrimidine; HPLC:tRet(grad20-100)=9.5; FAB-MS: (M+H)+=394.

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS06251911B1
Source datasetuspto-grants-2001_06
ORD IDord-534566f842d842e68e7c15ca96fc1336
Source noteuspto-grants-2001_06