3-Chloro-N-((2,2-dimethyl-4,6-dioxo-1,3-dioxan-5-ylidene)methyl)benzamide CAS 477885-68-0

Purity 97%+In StockPharmaceutical Standards
CAS No.477885-68-0
Molecular FormulaC14H12ClNO5
Molecular Weight309.70 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

3-Chloro-N-((2,2-dimethyl-4,6-dioxo-1,3-dioxan-5-ylidene)methyl)benzamide CAS 477885-68-0 chemical structure

Description

Under current pharmacopoeial and regulatory frameworks, quality-control requirements for this class of reference material explicitly involve the control of targets including 3-Chloro-N-((2,2-dimethyl-4,6-dioxo-1,3-dioxan-5-ylidene)methyl)benzamide.

CATO supplies 3-Chloro-N-((2,2-dimethyl-4,6-dioxo-1,3-dioxan-5-ylidene)methyl)benzamide (CAS 477885-68-0), a certified reference material (molecular formula C14H12ClNO5, MW 309.70 g/mol) for analytical method development and quality control.

Structurally, 3-Chloro-N-((2,2-dimethyl-4,6-dioxo-1,3-dioxan-5-ylidene)methyl)benzamide (C14H12ClNO5) 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 9.0, corresponding to approximately 9 ring(s) or double-bond equivalent(s). With a molecular weight of 309.70 g/mol, it falls into the moderately-high-molecular-weight range. Halogen substitution (F/Cl/Br/I) produces a distinctive isotope pattern in mass spectrometry, a valuable aid for qualitative confirmation.

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.

The assigned purity is verified by mass-balance and quantitative NMR (qNMR) approaches, with the expanded uncertainty reported at a 95% confidence level (k=2). Batch homogeneity and stability are independently assessed for every lot.

Physical & Chemical Properties

Molecular FormulaC14H12ClNO5
Molecular Weight309.70 g/mol
AppearancePale yellow to yellow crystalline powder. (slight halide-like odor)
Purity97%+
StorageStore at 2-8°C, protect from light, keep sealed and dry
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)9.0
UV AbsorptionUV-absorbing
Structural FeaturesAromatic ring present
CAS Registry Year (est.)2025
Halogen ContentCl-containing
Nitrogen Atoms1

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