5,7-Diiodo-3-(4-(trifluoromethyl)benzoyl)benzo[d]oxazol-2(3H)-one CAS 439107-45-6

Purity 97%+In StockPharmaceutical Standards
CAS No.439107-45-6
Molecular FormulaC15H6F3I2NO3
Molecular Weight559.02 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

5,7-Diiodo-3-(4-(trifluoromethyl)benzoyl)benzo[d]oxazol-2(3H)-one CAS 439107-45-6 chemical structure

Description

The molecular framework of 5,7-Diiodo-3-(4-(trifluoromethyl)benzoyl)benzo[d]oxazol-2(3H)-one (C15H6F3I2NO3) is characterized by a nitrogen-containing heterocyclic scaffold, an amide group, a hydroxyl group, an ether linkage, fluorine/iodine substitution. In reversed-phase chromatography, its retention is governed primarily by its high hydrophobicity (logP), which provides a practical basis for HPLC-UV/DAD or LC-MS method development. The high carbon-to-hydrogen ratio imparts good lipophilicity, allowing liquid-liquid extraction with non-polar solvents such as n-hexane or ethyl acetate.

5,7-Diiodo-3-(4-(trifluoromethyl)benzoyl)benzo[d]oxazol-2(3H)-one (CAS 439107-45-6), molecular formula C15H6F3I2NO3 and molecular weight 559.02 g/mol, is a CATO reference standard with documented purity and traceability.

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.

CATO manufactures 5,7-Diiodo-3-(4-(trifluoromethyl)benzoyl)benzo[d]oxazol-2(3H)-one 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 FormulaC15H6F3I2NO3
Molecular Weight559.02 g/mol
AppearancePale yellow to yellow crystalline powder. (slight halide-like odor, low volatility)
Purity97%+
StorageStore at room temperature, protect from light, keep sealed and dry
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)11.0
UV AbsorptionUV-absorbing
Structural FeaturesAromatic ring present
CAS Registry Year (est.)2025
Halogen ContentF/I-containing
Nitrogen Atoms1

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