Nicotinoyl isothiocyanate CAS 111430-89-8

Purity 97%+In StockPharmaceutical Standards
CAS No.111430-89-8
Molecular FormulaC7H4N2OS
Molecular Weight164.18 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

Nicotinoyl isothiocyanate CAS 111430-89-8 chemical structure

Description

Compared with other compounds in its class, the molecular weight of 164.18 g/mol gives Nicotinoyl isothiocyanate distinctive chromatographic separation conditions and mass-spectrometry parameter settings.

CATO supplies Nicotinoyl isothiocyanate (CAS 111430-89-8), a certified reference material (molecular formula C7H4N2OS, MW 164.18 g/mol) for analytical method development and quality control.

Structurally, Nicotinoyl isothiocyanate (C7H4N2OS) contains an amide group, sulfur-containing functionality, a hydroxyl group, an ether linkage, an aromatic ring system. The molecule exhibits a degree of unsaturation (DBE) of 7.0, corresponding to approximately 7 ring(s) or double-bond equivalent(s). With a molecular weight of 164.18 g/mol, it falls into the medium-molecular-weight range. Nitrogen-containing functional groups confer excellent ionization efficiency in positive-ion electrospray (ESI) mode, making the compound well suited to LC-MS/MS analysis.

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), Nicotinoyl isothiocyanate 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 FormulaC7H4N2OS
Molecular Weight164.18 g/mol
Purity97%+
StorageStore at 2-8°C, protect from light
Solubility (reference)Soluble in DMSO, DMF, methanol
StabilityLight-sensitive; avoid direct strong light
Degree of Unsaturation (DBE)7.0
UV AbsorptionUV-absorbing
Structural FeaturesAromatic ring present
CAS Registry Year (est.)1988
Nitrogen Atoms2
Sulfur Atoms1

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