4-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl](methyl)amino}-10-oxa-4-azatricyclo[5.2.1.0^{2,6}]dec-8-ene-3,5-dione CAS 1005068-83-6

Purity 97%+In StockPharmaceutical Standards
CAS No.1005068-83-6
Molecular FormulaC15H11ClF3N3O3
Molecular Weight373.71 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

4-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl](methyl)amino}-10-oxa-4-azatricyclo[5.2.1.0^{2,6}]dec-8-ene-3,5-dione CAS 1005068-83-6 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.

4-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl](methyl)amino}-10-oxa-4-azatricyclo[5.2.1.0^{2,6}]dec-8-ene-3,5-dione (CAS 1005068-83-6), molecular formula C15H11ClF3N3O3 and molecular weight 373.71 g/mol, is a CATO reference standard with documented purity and traceability.

Based on its molecular formula C15H11ClF3N3O3, 4-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl](methyl)amino}-10-oxa-4-azatricyclo[5.2.1.0^{2,6}]dec-8-ene-3,5-dione contains a nitrogen-containing heterocyclic scaffold, an amide group, a hydroxyl group, an ether linkage, fluorine/chlorine substitution; these features give the compound characteristic absorption bands in UV spectroscopy. The molecular weight of 373.71 g/mol is directly relevant to the identification of the molecular ion in mass spectrometry. 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 manufactures 4-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl](methyl)amino}-10-oxa-4-azatricyclo[5.2.1.0^{2,6}]dec-8-ene-3,5-dione 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 FormulaC15H11ClF3N3O3
Molecular Weight373.71 g/mol
AppearancePale yellow to yellow crystalline powder. (slight halide-like odor, low volatility)
Purity97%+
StorageStore at 2-8°C, protect from light, keep sealed and dry
Solubility (reference)Soluble in DMSO, DMF, methanol
StabilityMay oxidize slowly on prolonged air exposure; Light-sensitive; avoid direct strong light; Hygroscopic; reseal immediately after opening; Contains ester bond; hydrolyzes under strong alkaline conditions
Degree of Unsaturation (DBE)10.0
UV AbsorptionUV-absorbing
Structural FeaturesAromatic ring present
CAS Registry Year (est.)1988
Halogen ContentF/Cl-containing
Nitrogen Atoms3

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