1-(benzylsulfanyl)-2-(chloromethyl)benzene CAS 4521-46-4
| CAS No. | 4521-46-4 |
| Molecular Formula | C14H13ClS |
| Molecular Weight | 248.77 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
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.
CATO supplies 1-(benzylsulfanyl)-2-(chloromethyl)benzene (CAS 4521-46-4), a certified reference material (molecular formula C14H13ClS, MW 248.77 g/mol) for analytical method development and quality control.
Based on its molecular formula C14H13ClS, 1-(benzylsulfanyl)-2-(chloromethyl)benzene contains sulfur-containing functionality, chlorine substitution, a polycyclic aromatic system; these features give the compound characteristic absorption bands in UV spectroscopy. The molecular weight of 248.77 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.
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.
Physical & Chemical Properties
| Molecular Formula | C14H13ClS |
| Molecular Weight | 248.77 g/mol |
| Purity | 97%+ |
| Storage | Store at 2-8°C, protect from light, keep tightly closed to prevent evaporation |
| Solubility (reference) | Soluble in chloroform, dichloromethane, ethyl acetate |
| Stability | May oxidize slowly on prolonged air exposure; Light-sensitive; avoid direct strong light |
| Degree of Unsaturation (DBE) | 8.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 1958 |
| Halogen Content | Cl-containing |
| Sulfur Atoms | 1 |
Related benzylsulfanyl Standards
- 1-(benzylsulfanyl)-3-(chloromethyl)benzene (CAS 123926-49-8)
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- [2-(Benzylsulfanyl)pyrimidin-5-yl]boronic acid (CAS 2342610-74-4)
- 4-(Benzylsulfanyl)-6-chloropyrimidin-2-amine (CAS 478258-60-5)
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