1-Trifluoroacetyl-3-perfluorohexyl-5-(trifluoromethyl)pyrazole CAS 261778-38-5

Purity 97%+In StockPharmaceutical Standards
CAS No.261778-38-5
Molecular FormulaC12HF19N2O
Molecular Weight550.12 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

1-Trifluoroacetyl-3-perfluorohexyl-5-(trifluoromethyl)pyrazole CAS 261778-38-5 chemical structure

Description

The occurrence of 1-Trifluoroacetyl-3-perfluorohexyl-5-(trifluoromethyl)pyrazole is closely related to a nitrogen-containing heterocyclic scaffold, an amide group, a hydroxyl group, an ether linkage, fluorine substitution in its molecular formula, which determines its behaviour during synthesis, purification, or degradation.

1-Trifluoroacetyl-3-perfluorohexyl-5-(trifluoromethyl)pyrazole (CAS 261778-38-5), molecular formula C12HF19N2O and molecular weight 550.12 g/mol, is a CATO reference standard with documented purity and traceability.

Owing to a nitrogen-containing heterocyclic scaffold, an amide group, a hydroxyl group, an ether linkage, fluorine substitution, 1-Trifluoroacetyl-3-perfluorohexyl-5-(trifluoromethyl)pyrazole is typically off-white to pale yellow crystalline powder. Its solid-state physicochemical attributes — including a molecular weight of 550.12 g/mol — guide the selection of appropriate sample preparation and analytical techniques. Halogen substitution (F/Cl/Br/I) produces a distinctive isotope pattern in mass spectrometry, a valuable aid for qualitative confirmation.

Recommended for analytical method development and validation; each product is supplied with a full Certificate of Analysis (COA) ensuring ISO 17034 metrological traceability.

The assigned purity is verified by mass-balance and quantitative NMR (qNMR) approaches, with the expanded uncertainty reported at a 95% confidence level (k=2). Batch homogeneity and stability are independently assessed for every lot.

Physical & Chemical Properties

Molecular FormulaC12HF19N2O
Molecular Weight550.12 g/mol
AppearanceOff-white to pale yellow crystalline powder. (slight halide-like odor, low volatility)
Purity97%+
StorageStore at room temperature, protect from light
Solubility (reference)Soluble in DMSO, DMF, methanol
StabilityMay oxidize slowly on prolonged air exposure; Light-sensitive; avoid direct strong light
Degree of Unsaturation (DBE)4.0
UV AbsorptionUV-absorbing
Structural FeaturesAromatic ring present
CAS Registry Year (est.)2025
Halogen ContentF-containing
Nitrogen Atoms2

Related Trifluoroacetyl Standards

Recommended Standards

Why CATO?