Methyl 2-(4-cyano-3-fluorophenyl)acetate CAS 444807-50-5

Purity 97%+In StockPharmaceutical Standards
CAS No.444807-50-5
Molecular FormulaC10H8FNO2
Molecular Weight193.17 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

Methyl 2-(4-cyano-3-fluorophenyl)acetate CAS 444807-50-5 chemical structure

Description

Compared with other compounds in its class, the molecular weight of 193.17 g/mol gives Methyl 2-(4-cyano-3-fluorophenyl)acetate distinctive chromatographic separation conditions and mass-spectrometry parameter settings.

Methyl 2-(4-cyano-3-fluorophenyl)acetate (CAS 444807-50-5) is a high-purity analytical reference standard with the molecular formula C10H8FNO2 and a molecular weight of 193.17 g/mol.

Structurally, Methyl 2-(4-cyano-3-fluorophenyl)acetate (C10H8FNO2) contains a nitrogen-containing heterocyclic scaffold, an amide group, a hydroxyl group, an ether linkage, fluorine substitution. The molecule exhibits a degree of unsaturation (DBE) of 7.0, corresponding to approximately 7 ring(s) or double-bond equivalent(s). With a molecular weight of 193.17 g/mol, it falls into the medium-molecular-weight range. The aromatic system may exhibit native fluorescence, enabling detection with a fluorescence detector (FLD).

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 Methyl 2-(4-cyano-3-fluorophenyl)acetate 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 FormulaC10H8FNO2
Molecular Weight193.17 g/mol
AppearanceOff-white to pale yellow crystalline powder. (slight halide-like odor, faint amine-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)7.0
UV AbsorptionUV-absorbing
Structural FeaturesAromatic ring present
CAS Registry Year (est.)2025
Halogen ContentF-containing
Nitrogen Atoms1

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