2-(4-(((3-(Trifluoromethyl)phenyl)thio)methyl)phenyl)benzo[d]thiazole CAS 400087-79-8

Purity 97%+In StockPharmaceutical Standards
CAS No.400087-79-8
Molecular FormulaC21H14F3NS2
Molecular Weight401.47 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

2-(4-(((3-(Trifluoromethyl)phenyl)thio)methyl)phenyl)benzo[d]thiazole CAS 400087-79-8 chemical structure

Description

As a certified reference material (CRM), 2-(4-(((3-(Trifluoromethyl)phenyl)thio)methyl)phenyl)benzo[d]thiazole meets the metrological traceability requirements of ISO/IEC 17025 laboratories. Batch-to-batch consistency is monitored via control charts to guarantee comparable assigned values across lots.

2-(4-(((3-(Trifluoromethyl)phenyl)thio)methyl)phenyl)benzo[d]thiazole (CAS 400087-79-8), molecular formula C21H14F3NS2 and molecular weight 401.47 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, 2-(4-(((3-(Trifluoromethyl)phenyl)thio)methyl)phenyl)benzo[d]thiazole is typically pale yellow to yellow crystalline powder. Its solid-state physicochemical attributes — including a molecular weight of 401.47 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.

Physical & Chemical Properties

Molecular FormulaC21H14F3NS2
Molecular Weight401.47 g/mol
Purity97%+
StorageStore at room temperature, protect from light
Solubility (reference)Soluble in chloroform, dichloromethane, ethyl acetate
StabilityMay oxidize slowly on prolonged air exposure; Light-sensitive; avoid direct strong light
Degree of Unsaturation (DBE)14.0
UV AbsorptionUV-absorbing
Structural FeaturesAromatic ring present
CAS Registry Year (est.)2025
Halogen ContentF-containing
Nitrogen Atoms1
Sulfur Atoms2

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