1-((2,5-Dichlorophenyl)thio)propan-2-one CAS 40806-14-2

Purity 97%+In StockPharmaceutical Standards
CAS No.40806-14-2
Molecular FormulaC9H8Cl2OS
Molecular Weight235.13 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

1-((2,5-Dichlorophenyl)thio)propan-2-one CAS 40806-14-2 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 1-((2,5-Dichlorophenyl)thio)propan-2-one.

1-((2,5-Dichlorophenyl)thio)propan-2-one (CAS 40806-14-2) is a high-purity analytical reference standard with the molecular formula C9H8Cl2OS and a molecular weight of 235.13 g/mol.

Structurally, 1-((2,5-Dichlorophenyl)thio)propan-2-one (C9H8Cl2OS) 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 235.13 g/mol, it falls into the medium-molecular-weight range. The aromatic system may exhibit native fluorescence, enabling detection with a fluorescence detector (FLD).

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 FormulaC9H8Cl2OS
Molecular Weight235.13 g/mol
Purity97%+
StorageStore at room temperature, keep tightly closed to prevent evaporation
Solubility (reference)Soluble in methanol, acetonitrile, DMSO, water (slightly soluble)
StabilityMay oxidize slowly on prolonged air exposure
Degree of Unsaturation (DBE)5.0
UV AbsorptionUV-absorbing
Structural FeaturesAromatic ring present
CAS Registry Year (est.)1968
Halogen ContentCl-containing
Sulfur Atoms1

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