3-isothiocyanatoprop-1-yne 54122-88-2 Propargyl isothiocyanate CAS 54122-88-2

Purity 97%+In StockPharmaceutical Standards
CAS No.54122-88-2
Molecular FormulaC4H3NS
Molecular Weight97.14 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

3-isothiocyanatoprop-1-yne
54122-88-2
Propargyl isothiocyanate CAS 54122-88-2 chemical structure

Description

The occurrence of 3-isothiocyanatoprop-1-yne 54122-88-2 Propargyl isothiocyanate is closely related to a nitrile group, sulfur-containing functionality in its molecular formula, which determines its behaviour during synthesis, purification, or degradation.

CATO supplies 3-isothiocyanatoprop-1-yne 54122-88-2 Propargyl isothiocyanate (CAS 54122-88-2), a certified reference material (molecular formula C4H3NS, MW 97.14 g/mol) for analytical method development and quality control.

Based on its molecular formula C4H3NS, 3-isothiocyanatoprop-1-yne 54122-88-2 Propargyl isothiocyanate contains a nitrile group, sulfur-containing functionality; these features give the compound characteristic absorption bands in UV spectroscopy. The molecular weight of 97.14 g/mol is directly relevant to the identification of the molecular ion in mass spectrometry. The presence of an aromatic ring or conjugated system gives the compound characteristic absorption bands in the UV-Vis region, making it well suited to UV or diode-array detection (DAD).

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.

CATO manufactures 3-isothiocyanatoprop-1-yne 54122-88-2 Propargyl isothiocyanate under ISO 17034:2016 accreditation with dual CNAS and ANAB accreditation. Each batch is characterized by orthogonal methods and supplied with a full Certificate of Analysis (COA), ensuring metrological traceability.

Physical & Chemical Properties

Molecular FormulaC4H3NS
Molecular Weight97.14 g/mol
Purity97%+
StorageStore at 2-8°C, protect from light
Solubility (reference)Soluble in methanol, acetonitrile, DMSO
StabilityLight-sensitive; avoid direct strong light
Degree of Unsaturation (DBE)4.0
UV AbsorptionUV-absorbing
CAS Registry Year (est.)1972
Nitrogen Atoms1
Sulfur Atoms1

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