1-[4-(Trifluoromethyl)phenyl]-2-hexanone CAS 477202-15-6

Purity 97%+In StockPharmaceutical Standards
CAS No.477202-15-6
Molecular FormulaC13H15F3O
Molecular Weight244.25 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

1-[4-(Trifluoromethyl)phenyl]-2-hexanone CAS 477202-15-6 chemical structure

Description

The occurrence of 1-[4-(Trifluoromethyl)phenyl]-2-hexanone is closely related to a hydroxyl group, an ether linkage, fluorine substitution, an aromatic ring system in its molecular formula, which determines its behaviour during synthesis, purification, or degradation.

1-[4-(Trifluoromethyl)phenyl]-2-hexanone (CAS 477202-15-6), molecular formula C13H15F3O and molecular weight 244.25 g/mol, is a CATO reference standard with documented purity and traceability.

Owing to a hydroxyl group, an ether linkage, fluorine substitution, an aromatic ring system, 1-[4-(Trifluoromethyl)phenyl]-2-hexanone is typically off-white to pale yellow low-melting solid. Its solid-state physicochemical attributes — including a molecular weight of 244.25 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.

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.

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 FormulaC13H15F3O
Molecular Weight244.25 g/mol
Purity97%+
StorageStore at room temperature, keep tightly closed to prevent evaporation
Solubility (reference)Soluble in chloroform, dichloromethane, ethyl acetate, DMSO
StabilityMay oxidize slowly on prolonged air exposure
Degree of Unsaturation (DBE)5.0
UV AbsorptionUV-absorbing
Structural FeaturesAromatic ring present
CAS Registry Year (est.)2025
Halogen ContentF-containing

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Why CATO?