2-((tert-Butoxycarbonyl)amino)-4-fluoro-3-methylbenzoic acid CAS 2248394-48-9

Purity 97%+In StockPharmaceutical Standards
CAS No.2248394-48-9
Molecular FormulaC13H16FNO4
Molecular Weight269.27 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

2-((tert-Butoxycarbonyl)amino)-4-fluoro-3-methylbenzoic acid CAS 2248394-48-9 chemical structure

Description

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

2-((tert-Butoxycarbonyl)amino)-4-fluoro-3-methylbenzoic acid (CAS 2248394-48-9) is a high-purity analytical reference standard with the molecular formula C13H16FNO4 and a molecular weight of 269.27 g/mol.

2-((tert-Butoxycarbonyl)amino)-4-fluoro-3-methylbenzoic acid (C13H16FNO4) contains a nitrogen-containing heterocyclic scaffold, an amide group, a hydroxyl group, an ether linkage, fluorine substitution. It is notably hygroscopic, halogen substitution raises its density and boiling point, the carboxyl group imparts weak acidity; these physicochemical properties determine the optimal preparation and storage of its standard solutions. Halogen substitution (F/Cl/Br/I) produces a distinctive isotope pattern in mass spectrometry, a valuable aid for qualitative confirmation.

As a certified reference material (CRM), 2-((tert-Butoxycarbonyl)amino)-4-fluoro-3-methylbenzoic acid 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 FormulaC13H16FNO4
Molecular Weight269.27 g/mol
AppearanceOff-white to pale yellow crystalline powder. (slight halide-like odor)
Purity97%+
StorageStore at 2-8°C, protect from light, keep sealed and dry, keep tightly closed to prevent evaporation
Solubility (reference)Soluble in methanol, acetonitrile, DMSO, water (slightly soluble)
StabilityMay oxidize slowly on prolonged air exposure; Light-sensitive; avoid direct strong light; Hygroscopic; reseal immediately after opening; Contains ester bond; hydrolyzes under strong alkaline conditions
Degree of Unsaturation (DBE)6.0
UV AbsorptionUV-absorbing
Structural FeaturesAromatic ring present
CAS Registry Year (est.)1998
Halogen ContentF-containing
Nitrogen Atoms1

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