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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 989244Generated: October 29, 2026

Water → HCID 18005393, compound

https://huagongshe.com/reaction/989244

Reaction equation

Participants

RoleNameHCIDCharge
ReactantWaterHCID 962—
ReactantBromineHCID 24408—
ReactantSodium thiocyanateHCID 516871—
ReactantHCID 15869735HCID 15869735—
SolventMethanolHCID 887—
ProductHCID 18005393HCID 1800539391.2%

Reaction Conditions

Temperature20 °C

Reaction Steps

Bromine (0.5 ml) was added over 10 minutes to a stirred solution of sodium thiocyanate (1.7 g) in anhydrous methanol at −65° C. A solution of 5-amino-1-(2-chloro-4-(trifluoromethyl)phenyl]-1-H-pyrazole-3-carbonitrile (1.5 g) in anhydrous methanol was added over 10-minutes and the stirred mixture allowed to warm to 20° C. over 16-hours. After pouring into water the precipitate was collected and dried to give 5-amino-1-[2-chloro-4-(trifluoromethyl)phenyl]-4-thiocyanato-1H-pyrazole-3-carbonitrile (1.64 g). HPLC (C-18 column, eluting with 3:1 CH3CN/H2O at 1.0 ml/min.) showed the compound as a peak of 86.6% area at 5.11 minutes.

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS06638956B2
Source datasetuspto-grants-2003_10
ORD IDord-2a802a26d7f740a798e4b000e5c73079
Source noteuspto-grants-2003_10