Back
HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1626103Generated: November 1, 2026

Hexane → HCID 71008528, compound

https://huagongshe.com/reaction/1626103

Reaction equation

Participants

RoleNameHCIDCharge
ReactantHexaneHCID 8058—
ReactantCyanogen BromideHCID 10476—
ReactantSodium AcetateHCID 517045—
ReactantHCID 71008948HCID 71008948—
SolventEthanolHCID 702—
SolventEthyl AcetateHCID 8857—
ProductHCID 71008528HCID 7100852858.5%

Reaction Conditions

Temperature40 °C

Reaction Steps

A solution of (R)-3-amino-3-[1-(3-bromo-phenyl)-1H-pyrazol-4-yl]-2,2-difluoro-butan-1-ol (5.1 g, 14.73 mmol) and sodium acetate (3.62 g, 44.2 mmol) in ethanol (90 ml) was warmed to 40° C. Cyanogen bromide (1.71 g, 16.21 mmol) was added and the mixture allowed to stir at 40° C. for 16 hours. Removal of the solvent at reduced pressure followed by purification of the resultant crude material by column chromatography on silica gel using a 3:2-mixture of hexane and ethyl acetate as the eluent yielded the (R)-1-[1-(3-bromo-phenyl)-1H-pyrazol-4-yl]-3-cyanato-2,2-difluoro-1-methyl-propylamine (3.2 g, 58% yield) as a colorless sticky solid. MS (ISP): m/z=369.2 [M+H]+.

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS08785436B2
Source datasetuspto-grants-2014_07
ORD IDord-c3b21748bf5247ddbe596fc82fc3f107
Source noteuspto-grants-2014_07