4-((3,4-Dichlorophenyl)thio)butan-2-one CAS 1044062-42-1

Purity 97%+In StockPharmaceutical Standards
CAS No.1044062-42-1
Molecular FormulaC10H10Cl2OS
Molecular Weight249.16 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

4-((3,4-Dichlorophenyl)thio)butan-2-one CAS 1044062-42-1 chemical structure

Description

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 supplies 4-((3,4-Dichlorophenyl)thio)butan-2-one (CAS 1044062-42-1), a certified reference material (molecular formula C10H10Cl2OS, MW 249.16 g/mol) for analytical method development and quality control.

Structurally, 4-((3,4-Dichlorophenyl)thio)butan-2-one (C10H10Cl2OS) contains sulfur-containing functionality, a hydroxyl group, an ether linkage, chlorine substitution, an aromatic ring system. The molecule exhibits a degree of unsaturation (DBE) of 5.0, corresponding to approximately 5 ring(s) or double-bond equivalent(s). With a molecular weight of 249.16 g/mol, it falls into the medium-molecular-weight range. Halogen substitution (F/Cl/Br/I) produces a distinctive isotope pattern in mass spectrometry, a valuable aid for qualitative confirmation.

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 FormulaC10H10Cl2OS
Molecular Weight249.16 g/mol
Purity97%+
StorageStore at room temperature, keep tightly closed to prevent evaporation
Solubility (reference)Soluble in chloroform, dichloromethane, ethyl acetate, DMSO
StabilityMay oxidize slowly on prolonged air exposure
Degree of Unsaturation (DBE)5.0
UV AbsorptionUV-absorbing
Structural FeaturesAromatic ring present
CAS Registry Year (est.)1988
Halogen ContentCl-containing
Sulfur Atoms1

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