4-(4-Chloro-3-fluorophenoxy)benzonitrile CAS 449778-68-1

Purity 97%+In StockPharmaceutical Standards
CAS No.449778-68-1
Molecular FormulaC13H7ClFNO
Molecular Weight247.65 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

4-(4-Chloro-3-fluorophenoxy)benzonitrile CAS 449778-68-1 chemical structure

Description

The occurrence of 4-(4-Chloro-3-fluorophenoxy)benzonitrile is closely related to a nitrogen-containing heterocyclic scaffold, an amide group, a hydroxyl group, an ether linkage, fluorine/chlorine substitution in its molecular formula, which determines its behaviour during synthesis, purification, or degradation.

4-(4-Chloro-3-fluorophenoxy)benzonitrile (CAS 449778-68-1), molecular formula C13H7ClFNO and molecular weight 247.65 g/mol, is a CATO reference standard with documented purity and traceability.

Based on its molecular formula C13H7ClFNO, 4-(4-Chloro-3-fluorophenoxy)benzonitrile 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 247.65 g/mol is directly relevant to the identification of the molecular ion in mass spectrometry. The presence of an aromatic ring or conjugated system gives the compound characteristic absorption bands in the UV-Vis region, making it well suited to UV or diode-array detection (DAD).

Recommended for analytical method development and validation; each product is supplied with a full Certificate of Analysis (COA) ensuring ISO 17034 metrological traceability.

As a certified reference material (CRM), 4-(4-Chloro-3-fluorophenoxy)benzonitrile 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.

Physical & Chemical Properties

Molecular FormulaC13H7ClFNO
Molecular Weight247.65 g/mol
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
Degree of Unsaturation (DBE)10.0
UV AbsorptionUV-absorbing
Structural FeaturesAromatic ring present
CAS Registry Year (est.)2025
Halogen ContentF/Cl-containing
Nitrogen Atoms1

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