3,4-Dichloro-N-(3-(hex-1-yn-1-yl)phenyl)benzamide CAS 861209-79-2

Purity 97%+In StockPharmaceutical Standards
CAS No.861209-79-2
Molecular FormulaC19H17Cl2NO
Molecular Weight346.25 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

3,4-Dichloro-N-(3-(hex-1-yn-1-yl)phenyl)benzamide CAS 861209-79-2 chemical structure

Description

Compared with other compounds in its class, the molecular weight of 346.25 g/mol gives 3,4-Dichloro-N-(3-(hex-1-yn-1-yl)phenyl)benzamide distinctive chromatographic separation conditions and mass-spectrometry parameter settings.

3,4-Dichloro-N-(3-(hex-1-yn-1-yl)phenyl)benzamide (CAS 861209-79-2), molecular formula C19H17Cl2NO and molecular weight 346.25 g/mol, is a CATO reference standard with documented purity and traceability.

3,4-Dichloro-N-(3-(hex-1-yn-1-yl)phenyl)benzamide (C19H17Cl2NO) contains a steroid core, an amide group, a hydroxyl group, an ether linkage, chlorine substitution. Halogen substitution raises its density and boiling point, its high carbon-to-hydrogen ratio confers good lipid solubility; 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 FormulaC19H17Cl2NO
Molecular Weight346.25 g/mol
AppearancePale yellow to yellow crystalline powder. (slight halide-like odor, low volatility)
Purity97%+
StorageStore at 2-8°C, protect from light
Solubility (reference)Soluble in chloroform, dichloromethane, ethyl acetate, DMSO
StabilityMay oxidize slowly on prolonged air exposure; Light-sensitive; avoid direct strong light
Degree of Unsaturation (DBE)11.0
UV AbsorptionUV-absorbing
Structural FeaturesAromatic ring present
CAS Registry Year (est.)1987
Halogen ContentCl-containing
Nitrogen Atoms1

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