4-Allyl-5-(3-methylfuran-2-yl)-4h-1,2,4-triazole-3-thiol CAS 556006-98-5

Purity 97%+In StockPharmaceutical Standards
CAS No.556006-98-5
Molecular FormulaC10H11N3OS
Molecular Weight221.28 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

4-Allyl-5-(3-methylfuran-2-yl)-4h-1,2,4-triazole-3-thiol CAS 556006-98-5 chemical structure

Description

Under current pharmacopoeial and regulatory frameworks, quality-control requirements for this class of reference material explicitly involve the control of targets including 4-Allyl-5-(3-methylfuran-2-yl)-4h-1,2,4-triazole-3-thiol.

4-Allyl-5-(3-methylfuran-2-yl)-4h-1,2,4-triazole-3-thiol (CAS 556006-98-5) is a high-purity analytical reference standard with the molecular formula C10H11N3OS and a molecular weight of 221.28 g/mol.

Based on its molecular formula C10H11N3OS, 4-Allyl-5-(3-methylfuran-2-yl)-4h-1,2,4-triazole-3-thiol contains a nitrogen-containing heterocyclic scaffold, an amide group, sulfur-containing functionality, a hydroxyl group, an ether linkage; these features give the compound characteristic absorption bands in UV spectroscopy. The molecular weight of 221.28 g/mol is directly relevant to the identification of the molecular ion in mass spectrometry. Nitrogen-containing functional groups confer excellent ionization efficiency in positive-ion electrospray (ESI) mode, making the compound well suited to LC-MS/MS analysis.

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

The assigned purity is verified by mass-balance and quantitative NMR (qNMR) approaches, with the expanded uncertainty reported at a 95% confidence level (k=2). Batch homogeneity and stability are independently assessed for every lot.

Physical & Chemical Properties

Molecular FormulaC10H11N3OS
Molecular Weight221.28 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.)1984
Nitrogen Atoms3
Sulfur Atoms1

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