3-Phenyl-6-(trifluoromethyl)-5-((3-(trifluoromethyl)benzyl)thio)-1,2,4-triazine CAS 478048-13-4

Purity 97%+In StockPharmaceutical Standards
CAS No.478048-13-4
Molecular FormulaC18H11F6N3S
Molecular Weight415.36 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

3-Phenyl-6-(trifluoromethyl)-5-((3-(trifluoromethyl)benzyl)thio)-1,2,4-triazine CAS 478048-13-4 chemical structure

Description

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.

3-Phenyl-6-(trifluoromethyl)-5-((3-(trifluoromethyl)benzyl)thio)-1,2,4-triazine (CAS 478048-13-4), molecular formula C18H11F6N3S and molecular weight 415.36 g/mol, is a CATO reference standard with documented purity and traceability.

Owing to a nitrogen-containing heterocyclic scaffold, a nitrile group, sulfur-containing functionality, fluorine substitution, 3-Phenyl-6-(trifluoromethyl)-5-((3-(trifluoromethyl)benzyl)thio)-1,2,4-triazine is typically pale yellow to yellow crystalline powder. Its solid-state physicochemical attributes — including a molecular weight of 415.36 g/mol — guide the selection of appropriate sample preparation and analytical techniques. The high carbon-to-hydrogen ratio imparts good lipophilicity, allowing liquid-liquid extraction with non-polar solvents such as n-hexane or ethyl acetate.

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 FormulaC18H11F6N3S
Molecular Weight415.36 g/mol
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)12.0
UV AbsorptionUV-absorbing
Structural FeaturesAromatic ring present
CAS Registry Year (est.)2025
Halogen ContentF-containing
Nitrogen Atoms3
Sulfur Atoms1

Related Phenyl Standards

Recommended Standards

Why CATO?