3-(4-Chlorophenyl)-4H-cyclohepta[d]isoxazol-4-one CAS 109072-31-3

Purity 97%+In StockPharmaceutical Standards
CAS No.109072-31-3
Molecular FormulaC14H8ClNO2
Molecular Weight257.67 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

3-(4-Chlorophenyl)-4H-cyclohepta[d]isoxazol-4-one CAS 109072-31-3 chemical structure

Description

CATO manufactures 3-(4-Chlorophenyl)-4H-cyclohepta[d]isoxazol-4-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.

3-(4-Chlorophenyl)-4H-cyclohepta[d]isoxazol-4-one (CAS 109072-31-3) is a high-purity analytical reference standard with the molecular formula C14H8ClNO2 and a molecular weight of 257.67 g/mol.

Structurally, 3-(4-Chlorophenyl)-4H-cyclohepta[d]isoxazol-4-one (C14H8ClNO2) contains a nitrogen-containing heterocyclic scaffold, an amide group, a hydroxyl group, an ether linkage, chlorine substitution. The molecule exhibits a degree of unsaturation (DBE) of 11.0, corresponding to approximately 11 ring(s) or double-bond equivalent(s). With a molecular weight of 257.67 g/mol, it falls into the medium-molecular-weight range. 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).

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 FormulaC14H8ClNO2
Molecular Weight257.67 g/mol
AppearancePale yellow to yellow crystalline powder. (slight halide-like odor)
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)11.0
UV AbsorptionUV-absorbing
Structural FeaturesAromatic ring present
CAS Registry Year (est.)1988
Halogen ContentCl-containing
Nitrogen Atoms1

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