1-ethynyl-3-phenylbicyclo[1.1.1]pentane CAS 1955524-44-3

Purity 97%+In StockPharmaceutical Standards
CAS No.1955524-44-3
Molecular FormulaC13H18
Molecular Weight174.28 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

1-ethynyl-3-phenylbicyclo[1.1.1]pentane CAS 1955524-44-3 chemical structure

Description

1-ethynyl-3-phenylbicyclo[1.1.1]pentane (CAS 1955524-44-3) is a high-purity analytical reference standard with the molecular formula C13H18 and a molecular weight of 174.28 g/mol.

Owing to an aromatic ring system, 1-ethynyl-3-phenylbicyclo[1.1.1]pentane is typically off-white to pale yellow low-melting solid. Its solid-state physicochemical attributes — including a molecular weight of 174.28 g/mol — guide the selection of appropriate sample preparation and analytical techniques. The high carbon-to-hydrogen ratio imparts good lipophilicity, allowing liquid-liquid extraction with non-polar solvents such as n-hexane or ethyl acetate.

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 FormulaC13H18
Molecular Weight174.28 g/mol
Purity97%+
StorageStore at 2-8°C
Solubility (reference)Soluble in chloroform, dichloromethane, ethyl acetate
StabilityStable under recommended storage conditions
Degree of Unsaturation (DBE)5.0
UV AbsorptionUV-absorbing
Structural FeaturesAromatic ring present
CAS Registry Year (est.)1996

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