4'-((4-Fluorobenzyl)thio)-1'H-spiro[cyclohexane-1,2'-quinazoline] CAS 893786-15-7

Purity 97%+In StockPharmaceutical Standards
CAS No.893786-15-7
Molecular FormulaC20H21FN2S
Molecular Weight340.46 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

4'-((4-Fluorobenzyl)thio)-1'H-spiro[cyclohexane-1,2'-quinazoline] CAS 893786-15-7 chemical structure

Description

Based on its molecular formula C20H21FN2S, 4'-((4-Fluorobenzyl)thio)-1'H-spiro[cyclohexane-1,2'-quinazoline] contains a nitrogen-containing heterocyclic scaffold, a nitrile group, sulfur-containing functionality, fluorine substitution; these features give the compound characteristic absorption bands in UV spectroscopy. The molecular weight of 340.46 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.

4'-((4-Fluorobenzyl)thio)-1'H-spiro[cyclohexane-1,2'-quinazoline] (CAS 893786-15-7) is a high-purity analytical reference standard with the molecular formula C20H21FN2S and a molecular weight of 340.46 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.

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 FormulaC20H21FN2S
Molecular Weight340.46 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)11.0
UV AbsorptionUV-absorbing
Structural FeaturesAromatic ring present
CAS Registry Year (est.)1987
Halogen ContentF-containing
Nitrogen Atoms2
Sulfur Atoms1

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