4-(1-Bicyclo[2.2.1]hept-2-yl-ethyl)-5-(2-fluoro-phenoxymethyl)-4H-[1,2,4]triazole-3-thiol CAS 1005159-77-2

Purity 97%+In StockPharmaceutical Standards
CAS No.1005159-77-2
Molecular FormulaC18H22FN3OS
Molecular Weight347.45 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

4-(1-Bicyclo[2.2.1]hept-2-yl-ethyl)-5-(2-fluoro-phenoxymethyl)-4H-[1,2,4]triazole-3-thiol CAS 1005159-77-2 chemical structure

Description

Structurally, 4-(1-Bicyclo[2.2.1]hept-2-yl-ethyl)-5-(2-fluoro-phenoxymethyl)-4H-[1,2,4]triazole-3-thiol (C18H22FN3OS) contains a steroid core, an amide group, sulfur-containing functionality, a hydroxyl group, an ether linkage, fluorine substitution. The molecule exhibits a degree of unsaturation (DBE) of 9.0, corresponding to approximately 9 ring(s) or double-bond equivalent(s). With a molecular weight of 347.45 g/mol, it falls into the moderately-high-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).

4-(1-Bicyclo[2.2.1]hept-2-yl-ethyl)-5-(2-fluoro-phenoxymethyl)-4H-[1,2,4]triazole-3-thiol (CAS 1005159-77-2) is a high-purity analytical reference standard with the molecular formula C18H22FN3OS and a molecular weight of 347.45 g/mol.

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 4-(1-Bicyclo[2.2.1]hept-2-yl-ethyl)-5-(2-fluoro-phenoxymethyl)-4H-[1,2,4]triazole-3-thiol 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 FormulaC18H22FN3OS
Molecular Weight347.45 g/mol
Purity97%+
StorageStore at 2-8°C, protect from light
Solubility (reference)Soluble in DMSO, DMF, methanol
StabilityMay oxidize slowly on prolonged air exposure; Light-sensitive; avoid direct strong light
Degree of Unsaturation (DBE)9.0
UV AbsorptionUV-absorbing
Structural FeaturesAromatic ring present
CAS Registry Year (est.)1988
Halogen ContentF-containing
Nitrogen Atoms3
Sulfur Atoms1

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