2,2,2-Trifluoro-1-(7-(oxiran-2-yl)-3,4-dihydroisoquinolin-2(1H)-yl)ethan-1-one CAS 2126162-97-6

Purity 97%+In StockPharmaceutical Standards
CAS No.2126162-97-6
Molecular FormulaC13H12F3NO2
Molecular Weight271.24 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

2,2,2-Trifluoro-1-(7-(oxiran-2-yl)-3,4-dihydroisoquinolin-2(1H)-yl)ethan-1-one CAS 2126162-97-6 chemical structure

Description

Owing to a nitrogen-containing heterocyclic scaffold, an amide group, a hydroxyl group, an ether linkage, fluorine substitution, 2,2,2-Trifluoro-1-(7-(oxiran-2-yl)-3,4-dihydroisoquinolin-2(1H)-yl)ethan-1-one is typically off-white to pale yellow crystalline powder. Its solid-state physicochemical attributes — including a molecular weight of 271.24 g/mol — guide the selection of appropriate sample preparation and analytical techniques. Nitrogen-containing functional groups confer excellent ionization efficiency in positive-ion electrospray (ESI) mode, making the compound well suited to LC-MS/MS analysis.

CATO supplies 2,2,2-Trifluoro-1-(7-(oxiran-2-yl)-3,4-dihydroisoquinolin-2(1H)-yl)ethan-1-one (CAS 2126162-97-6), a certified reference material (molecular formula C13H12F3NO2, MW 271.24 g/mol) for analytical method development and quality control.

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 FormulaC13H12F3NO2
Molecular Weight271.24 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.)1997
Halogen ContentF-containing
Nitrogen Atoms1

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