3-Chloro-5-[(4-methoxyphenethyl)amino]-4-isothiazolecarbonitrile CAS 866009-34-9

Purity 97%+In StockPharmaceutical Standards
CAS No.866009-34-9
Molecular FormulaC13H12ClN3OS
Molecular Weight293.77 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

3-Chloro-5-[(4-methoxyphenethyl)amino]-4-isothiazolecarbonitrile CAS 866009-34-9 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 3-Chloro-5-[(4-methoxyphenethyl)amino]-4-isothiazolecarbonitrile.

CATO supplies 3-Chloro-5-[(4-methoxyphenethyl)amino]-4-isothiazolecarbonitrile (CAS 866009-34-9), a certified reference material (molecular formula C13H12ClN3OS, MW 293.77 g/mol) for analytical method development and quality control.

Owing to a nitrogen-containing heterocyclic scaffold, an amide group, sulfur-containing functionality, a hydroxyl group, an ether linkage, chlorine substitution, 3-Chloro-5-[(4-methoxyphenethyl)amino]-4-isothiazolecarbonitrile is typically pale yellow to yellow crystalline powder. Its solid-state physicochemical attributes — including a molecular weight of 293.77 g/mol — guide the selection of appropriate sample preparation and analytical techniques. 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).

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 FormulaC13H12ClN3OS
Molecular Weight293.77 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)9.0
UV AbsorptionUV-absorbing
Structural FeaturesAromatic ring present
CAS Registry Year (est.)1987
Halogen ContentCl-containing
Nitrogen Atoms3
Sulfur Atoms1

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