5-((Methylthio)methyl)isoxazole-3-carbonitrile CAS 84654-34-2

Purity 97%+In StockPharmaceutical Standards
CAS No.84654-34-2
Molecular FormulaC6H6N2OS
Molecular Weight154.19 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

5-((Methylthio)methyl)isoxazole-3-carbonitrile CAS 84654-34-2 chemical structure

Description

The occurrence of 5-((Methylthio)methyl)isoxazole-3-carbonitrile is closely related to an amide group, sulfur-containing functionality, a hydroxyl group, an ether linkage, an aromatic ring system in its molecular formula, which determines its behaviour during synthesis, purification, or degradation.

5-((Methylthio)methyl)isoxazole-3-carbonitrile (CAS 84654-34-2), molecular formula C6H6N2OS and molecular weight 154.19 g/mol, is a CATO reference standard with documented purity and traceability.

The molecular framework of 5-((Methylthio)methyl)isoxazole-3-carbonitrile (C6H6N2OS) is characterized by an amide group, sulfur-containing functionality, a hydroxyl group, an ether linkage, an aromatic ring system. In reversed-phase chromatography, its retention is governed primarily by the protonation state of its nitrogen-containing groups, which provides a practical basis for HPLC-UV/DAD or LC-MS method development. The aromatic system may exhibit native fluorescence, enabling detection with a fluorescence detector (FLD).

Recommended for analytical method development and validation; each product is supplied with a full Certificate of Analysis (COA) ensuring ISO 17034 metrological traceability.

As a certified reference material (CRM), 5-((Methylthio)methyl)isoxazole-3-carbonitrile 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 FormulaC6H6N2OS
Molecular Weight154.19 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)5.0
UV AbsorptionUV-absorbing
Structural FeaturesAromatic ring present
CAS Registry Year (est.)1981
Nitrogen Atoms2
Sulfur Atoms1

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