4-(2-Fluorophenyl)-2-thioxo-1,2-dihydropyridine-3-carbonitrile CAS 1707567-06-3

Purity 97%+In StockPharmaceutical Standards
CAS No.1707567-06-3
Molecular FormulaC12H7FN2S
Molecular Weight230.26 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

4-(2-Fluorophenyl)-2-thioxo-1,2-dihydropyridine-3-carbonitrile CAS 1707567-06-3 chemical structure

Description

Compared with other compounds in its class, the molecular weight of 230.26 g/mol gives 4-(2-Fluorophenyl)-2-thioxo-1,2-dihydropyridine-3-carbonitrile distinctive chromatographic separation conditions and mass-spectrometry parameter settings.

4-(2-Fluorophenyl)-2-thioxo-1,2-dihydropyridine-3-carbonitrile (CAS 1707567-06-3), molecular formula C12H7FN2S and molecular weight 230.26 g/mol, is a CATO reference standard with documented purity and traceability.

Structurally, 4-(2-Fluorophenyl)-2-thioxo-1,2-dihydropyridine-3-carbonitrile (C12H7FN2S) contains a nitrogen-containing heterocyclic scaffold, a nitrile group, sulfur-containing functionality, fluorine substitution. The molecule exhibits a degree of unsaturation (DBE) of 10.0, corresponding to approximately 10 ring(s) or double-bond equivalent(s). With a molecular weight of 230.26 g/mol, it falls into the medium-molecular-weight range. 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 FormulaC12H7FN2S
Molecular Weight230.26 g/mol
Purity97%+
StorageStore at 2-8°C, protect from light, keep tightly closed to prevent evaporation
Solubility (reference)Soluble in DMSO, DMF, methanol
StabilityMay oxidize slowly on prolonged air exposure; Light-sensitive; avoid direct strong light
Degree of Unsaturation (DBE)10.0
UV AbsorptionUV-absorbing
Structural FeaturesAromatic ring present
CAS Registry Year (est.)1994
Halogen ContentF-containing
Nitrogen Atoms2
Sulfur Atoms1

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