3-(Methylthio)phenyl isothiocyanate 1-isothiocyanato-3-methylsulfanyl-benzene 1-isothiocyanato-3-(methylsulfanyl)benzene 51333-80-3 CAS 51333-80-3

Purity 97%+In StockPharmaceutical Standards
CAS No.51333-80-3
Molecular FormulaC8H7NS2
Molecular Weight181.28 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

3-(Methylthio)phenyl isothiocyanate
1-isothiocyanato-3-methylsulfanyl-benzene
1-isothiocyanato-3-(methylsulfanyl)benzene
51333-80-3 CAS 51333-80-3 chemical structure

Description

3-(Methylthio)phenyl isothiocyanate 1-isothiocyanato-3-methylsulfanyl-benzene 1-isothiocyanato-3-(methylsulfanyl)benzene 51333-80-3 (CAS 51333-80-3) is a high-purity analytical reference standard with the molecular formula C8H7NS2 and a molecular weight of 181.28 g/mol.

3-(Methylthio)phenyl isothiocyanate 1-isothiocyanato-3-methylsulfanyl-benzene 1-isothiocyanato-3-(methylsulfanyl)benzene 51333-80-3 (C8H7NS2) contains a nitrogen-containing heterocyclic scaffold, a nitrile group, sulfur-containing functionality. Its physicochemical properties are representative of its class; these physicochemical properties determine the optimal preparation and storage of its standard solutions. 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.

As a certified reference material (CRM), 3-(Methylthio)phenyl isothiocyanate 1-isothiocyanato-3-methylsulfanyl-benzene 1-isothiocyanato-3-(methylsulfanyl)benzene 51333-80-3 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 FormulaC8H7NS2
Molecular Weight181.28 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)6.0
UV AbsorptionUV-absorbing
Structural FeaturesAromatic ring present
CAS Registry Year (est.)1971
Nitrogen Atoms1
Sulfur Atoms2

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