2-(5,6-Diethyl-3-oxoisobenzofuran-1(3H)-ylidene)acetonitrile CAS 58138-46-8

Purity 97%+In StockPharmaceutical Standards
CAS No.58138-46-8
Molecular FormulaC14H13NO2
Molecular Weight227.26 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

2-(5,6-Diethyl-3-oxoisobenzofuran-1(3H)-ylidene)acetonitrile CAS 58138-46-8 chemical structure

Description

The occurrence of 2-(5,6-Diethyl-3-oxoisobenzofuran-1(3H)-ylidene)acetonitrile is closely related to a nitrogen-containing heterocyclic scaffold, an amide group, a hydroxyl group, an ether linkage in its molecular formula, which determines its behaviour during synthesis, purification, or degradation.

2-(5,6-Diethyl-3-oxoisobenzofuran-1(3H)-ylidene)acetonitrile (CAS 58138-46-8) is a high-purity analytical reference standard with the molecular formula C14H13NO2 and a molecular weight of 227.26 g/mol.

The molecular framework of 2-(5,6-Diethyl-3-oxoisobenzofuran-1(3H)-ylidene)acetonitrile (C14H13NO2) is characterized by a nitrogen-containing heterocyclic scaffold, an amide group, a hydroxyl group, an ether linkage. 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.

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 2-(5,6-Diethyl-3-oxoisobenzofuran-1(3H)-ylidene)acetonitrile 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 FormulaC14H13NO2
Molecular Weight227.26 g/mol
AppearancePale yellow to yellow crystalline powder
Purity97%+
StorageStore at 2-8°C, protect from light
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)9.0
UV AbsorptionUV-absorbing
Structural FeaturesAromatic ring present
CAS Registry Year (est.)1973
Nitrogen Atoms1

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