3-(tert-Butyl)-5-((phenylthio)methyl)-1H-pyrazole CAS 493038-65-6

Purity 97%+In StockPharmaceutical Standards
CAS No.493038-65-6
Molecular FormulaC14H18N2S
Molecular Weight246.37 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

3-(tert-Butyl)-5-((phenylthio)methyl)-1H-pyrazole CAS 493038-65-6 chemical structure

Description

3-(tert-Butyl)-5-((phenylthio)methyl)-1H-pyrazole (CAS 493038-65-6), molecular formula C14H18N2S and molecular weight 246.37 g/mol, is a CATO reference standard with documented purity and traceability.

Structurally, 3-(tert-Butyl)-5-((phenylthio)methyl)-1H-pyrazole (C14H18N2S) contains a nitrogen-containing heterocyclic scaffold, a nitrile group, sulfur-containing functionality. 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 246.37 g/mol, it falls into the medium-molecular-weight range. 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-(tert-Butyl)-5-((phenylthio)methyl)-1H-pyrazole 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 FormulaC14H18N2S
Molecular Weight246.37 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.)2025
Nitrogen Atoms2
Sulfur Atoms1

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