Butyl 2,4-dichloro-6-(phenylthio)pyrimidine-5-carboxylate CAS 87847-39-0

Purity 97%+In StockPharmaceutical Standards
CAS No.87847-39-0
Molecular FormulaC15H14Cl2N2O2S
Molecular Weight357.25 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

Butyl 2,4-dichloro-6-(phenylthio)pyrimidine-5-carboxylate CAS 87847-39-0 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 Butyl 2,4-dichloro-6-(phenylthio)pyrimidine-5-carboxylate.

Butyl 2,4-dichloro-6-(phenylthio)pyrimidine-5-carboxylate (CAS 87847-39-0), molecular formula C15H14Cl2N2O2S and molecular weight 357.25 g/mol, is a CATO reference standard with documented purity and traceability.

Based on its molecular formula C15H14Cl2N2O2S, Butyl 2,4-dichloro-6-(phenylthio)pyrimidine-5-carboxylate contains a nitrogen-containing heterocyclic scaffold, an amide group, a sulfone group, a hydroxyl group, an ether linkage, chlorine substitution; these features give the compound characteristic absorption bands in UV spectroscopy. The molecular weight of 357.25 g/mol is directly relevant to the identification of the molecular ion in mass spectrometry. The high carbon-to-hydrogen ratio imparts good lipophilicity, allowing liquid-liquid extraction with non-polar solvents such as n-hexane or ethyl acetate.

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 FormulaC15H14Cl2N2O2S
Molecular Weight357.25 g/mol
Purity97%+
StorageStore at 2-8°C, protect from light, keep sealed and dry
Solubility (reference)Soluble in DMSO, DMF, methanol
StabilityMay oxidize slowly on prolonged air exposure; Light-sensitive; avoid direct strong light; Hygroscopic; reseal immediately after opening; Contains ester bond; hydrolyzes under strong alkaline conditions
Degree of Unsaturation (DBE)9.0
UV AbsorptionUV-absorbing
Structural FeaturesAromatic ring present
CAS Registry Year (est.)1982
Halogen ContentCl-containing
Nitrogen Atoms2
Sulfur Atoms1

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Why CATO?