2H-Benzo[b][1,4]dioxepin-3(4H)-one CAS 27612-17-5

Purity 97%+In StockPharmaceutical Standards
CAS No.27612-17-5
Molecular FormulaC9H8O3
Molecular Weight164.16 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

2H-Benzo[b][1,4]dioxepin-3(4H)-one CAS 27612-17-5 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 2H-Benzo[b][1,4]dioxepin-3(4H)-one.

2H-Benzo[b][1,4]dioxepin-3(4H)-one (CAS 27612-17-5), molecular formula C9H8O3 and molecular weight 164.16 g/mol, is a CATO reference standard with documented purity and traceability.

Based on its molecular formula C9H8O3, 2H-Benzo[b][1,4]dioxepin-3(4H)-one contains a carboxylic acid group, a hydroxyl group, an ether linkage, an aromatic ring system; these features give the compound characteristic absorption bands in UV spectroscopy. The molecular weight of 164.16 g/mol is directly relevant to the identification of the molecular ion in mass spectrometry. 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.

As a certified reference material (CRM), 2H-Benzo[b][1,4]dioxepin-3(4H)-one 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 FormulaC9H8O3
Molecular Weight164.16 g/mol
AppearanceOff-white to pale yellow crystalline powder
Purity97%+
StorageStore at 2-8°C, protect from light, keep sealed and dry
Solubility (reference)Soluble in methanol, ethanol, DMSO
StabilityMay oxidize slowly on prolonged air exposure; Light-sensitive; avoid direct strong light; Hygroscopic; reseal immediately after opening
Degree of Unsaturation (DBE)6.0
UV AbsorptionUV-absorbing
Structural FeaturesAromatic ring present
CAS Registry Year (est.)1964

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