4,4,4-Trifluoro-2-(3-methoxyphenyl)-3-oxobutanenitrile CAS 22102-04-1

Purity 97%+In StockPharmaceutical Standards
CAS No.22102-04-1
Molecular FormulaC11H8F3NO2
Molecular Weight243.18 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

4,4,4-Trifluoro-2-(3-methoxyphenyl)-3-oxobutanenitrile CAS 22102-04-1 chemical structure

Description

The occurrence of 4,4,4-Trifluoro-2-(3-methoxyphenyl)-3-oxobutanenitrile 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.

4,4,4-Trifluoro-2-(3-methoxyphenyl)-3-oxobutanenitrile (CAS 22102-04-1) is a high-purity analytical reference standard with the molecular formula C11H8F3NO2 and a molecular weight of 243.18 g/mol.

4,4,4-Trifluoro-2-(3-methoxyphenyl)-3-oxobutanenitrile (C11H8F3NO2) contains a nitrogen-containing heterocyclic scaffold, an amide group, a hydroxyl group, an ether linkage, fluorine substitution. Halogen substitution raises its density and boiling point, its high carbon-to-hydrogen ratio confers good lipid solubility, the carboxyl group imparts weak acidity; these physicochemical properties determine the optimal preparation and storage of its standard solutions. The high carbon-to-hydrogen ratio imparts good lipophilicity, allowing liquid-liquid extraction with non-polar solvents such as n-hexane or ethyl acetate.

This reference standard is suitable for quantitative analysis on major chromatographic platforms including HPLC, GC, LC-MS/MS, and GC-MS, serving as an external calibration standard or a system suitability test reference material.

CATO manufactures 4,4,4-Trifluoro-2-(3-methoxyphenyl)-3-oxobutanenitrile under ISO 17034:2016 accreditation with dual CNAS and ANAB accreditation. Each batch is characterized by orthogonal methods and supplied with a full Certificate of Analysis (COA), ensuring metrological traceability.

Physical & Chemical Properties

Molecular FormulaC11H8F3NO2
Molecular Weight243.18 g/mol
AppearanceOff-white to pale yellow crystalline powder. (slight halide-like odor, low volatility)
Purity97%+
StorageStore at 2-8°C, protect from light, keep tightly closed to prevent evaporation
Solubility (reference)Soluble in chloroform, dichloromethane, ethyl acetate, DMSO
StabilityMay oxidize slowly on prolonged air exposure; Light-sensitive; avoid direct strong light; Contains ester bond; hydrolyzes under strong alkaline conditions
Degree of Unsaturation (DBE)7.0
UV AbsorptionUV-absorbing
Structural FeaturesAromatic ring present
CAS Registry Year (est.)1963
Halogen ContentF-containing
Nitrogen Atoms1

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