Rel-(1R,4S)-4-chlorocyclohex-2-en-1-yl acetate CAS 82736-39-8

Purity 97%+In StockPharmaceutical Standards
CAS No.82736-39-8
Molecular FormulaC6H9ClO
Molecular WeightN/A
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

Rel-(1R,4S)-4-chlorocyclohex-2-en-1-yl acetate CAS 82736-39-8 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 Rel-(1R,4S)-4-chlorocyclohex-2-en-1-yl acetate.

Rel-(1R,4S)-4-chlorocyclohex-2-en-1-yl acetate (CAS 82736-39-8) is a high-purity analytical reference standard with the molecular formula C6H9ClOC2H4O2 and a molecular weight of 192.64 g/mol.

Rel-(1R,4S)-4-chlorocyclohex-2-en-1-yl acetate (C6H9ClOC2H4O2) contains a carboxylic acid group, a hydroxyl group, an ether linkage, chlorine 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.

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 FormulaC6H9ClO C2H4O2
Molecular Weight192.64 g/mol
Purity97%+
StorageStore at 2-8°C, keep sealed and dry, keep tightly closed to prevent evaporation
Solubility (reference)Soluble in methanol, ethanol, DMSO
StabilityHygroscopic; reseal immediately after opening; Contains ester bond; hydrolyzes under strong alkaline conditions
Degree of Unsaturation (DBE)2.0
CAS Registry Year (est.)1980
Halogen ContentCl-containing

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